# Search results of SQL query from the Crystallography Open Database # Date and time performed: 2025-12-25T09:49:54+01:00 # Query: # SELECT data.* # FROM # data # WHERE # (status is null or status != 'retracted') and # (sg LIKE 'R 3 m :H' AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical')) # ORDER BY file asc file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold "1000051","5.487","0.001","5.487","0.001","9.156","0.003","90","","90","","120","","238.7","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Potasium nitrate - γ","","- K N O3 -","- K N O3 -","- K3 N3 O9 -","3","0.166667","","Nimmo, J. K.; Lucas, B. W.","The crystal structures of γ- and β-KNO~3~ and the α ←γ ←β phase transformations","Acta Crystallographica B (24,1968-38,1982)","1976","32","7","1968","1971","10.1107/S0567740876006894","","","","","","0.18","","","","","","","","","","","","","","","has coordinates","189448","2020-10-21","18:00:00","" "1007244","12.033","0.008","12.033","0.008","10.032","0.008","90","","90","","120","","1258","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Triammonium tetrachromatophosphate","","- Cr4 H12 N3 O16 P -","- Cr4 H12 N3 O16 P -","- Cr12 H36 N9 O48 P3 -","3","0.166667","","Averbuch-Pouchot, M T; Durif, A; Guitel, J C","Crystal structure of an ammonium phospho-chromate: (N H4)3 P Cr4 O16","Journal of Solid State Chemistry","1981","36","","381","384","10.1016/0022-4596(81)90450-3","","","","","","0.054","","","","","","","","","","","","","","","has coordinates","301771","2025-08-18","12:22:45","" "1008255","13.095","0.006","13.095","0.006","5.658","0.002","90","","90","","120","","840.2","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Uranium(VI) oxide tetrafluoride - α","","- F4 O U -","- F4 O U -","- F36 O9 U9 -","9","0.5","","Levy, J. H.; Taylor, J. C.; Wilson, P. W.","The structures of fluorides-XVII: neutron diffraction study of α-uranium oxide tetrafluoride","Journal of Inorganic and Nuclear Chemistry","1977","39","11","1989","1991","10.1016/0022-1902(77)80531-9","","","","","","0.15","","","","","","","","","","","","","","","has coordinates","200139","2020-10-21","18:00:00","" "1008468","4.204","0.002","4.204","0.002","26.728","0.009","90","","90","","120","","409.1","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Strontium ditin arsenide","","- As2 Sn2 Sr -","- As2 Sn2 Sr -","- As6 Sn6 Sr3 -","3","0.166667","","Eisenmann, B; Klein, J","Zintl-Phasen mit Schichtanionen: Darstellung und Kristallstrukturender isotypen Verbindungen SrSn~2~As~2~ und Sr~0.87~Ba~0.13~Sn~2~As~2~ sowie eine Einkristallstrukturbestimmung von KSnSb","Zeitschrift fuer Anorganische und Allgemeine Chemie","1991","598","","93","102","10.1002/zaac.19915980109","","","","","","0.033","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00","" "1008469","4.227","0.002","4.227","0.002","26.878","0.009","90","","90","","120","","415.9","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Strontium barium tin arsenide (0.87/0.13/2/2)","","- As2 Ba0.13 Sn2 Sr0.87 -","- As2 Ba0.13 Sn2 Sr0.87 -","- As6 Ba0.39 Sn6 Sr2.61 -","3","0.166667","","Eisenmann, B; Klein, J","Zintl-Phasen mit Schichtanionen: Darstellung und Kristallstrukturender isotypen Verbindungen SrSn~2~As~2~ und Sr~0.87~Ba~0.13~Sn~2~As~2~ sowie eine Einkristallstrukturbestimmung von KSnSb","Zeitschrift fuer Anorganische und Allgemeine Chemie","1991","598","","93","102","10.1002/zaac.19915980109","","","","","","0.031","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "1008844","4.112","0.001","4.112","0.001","29.495","0.006","90","","90","","120","","431.9","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Diantimony telluride diselenide","","- Sb2 Se2 Te -","- Sb2 Se2 Te -","- Sb6 Se6 Te3 -","3","0.166667","","Andriamihaja, A; Ibanez, A; Jumas, J C; Olivier-Fourcade, J; Philippot, E","Evolution structurale de la solution solide Sb2 Te(3-x) Se(x) (O < X < 2) dans le systeme Sb2 Te3 - Sb2 Se3","Revue de Chimie Minerale","1985","22","","357","368","","","","","","","0.0502","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00","" "1100051","12.6963024","0.0000003","12.6963024","0.0000003","7.9210911","0.0000007","90","","90","","120","0.3","1105.78","0.03","300","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Al65 Cr27 Fe8 -","- Al49.7401 Cr21.408 Fe5.35311 -","- Al49.7401 Cr21.408 Fe5.35311 -","","","","Brandon, J. K.; Pearson, W. B.; Riley, P. W.; Chien, C.; Stokhuyzen, R.","γ-Brasses with R cells","Acta Crystallographica Section B","1977","33","4","1088","1095","10.1107/S0567740877005433","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00","" "1100602","17.842","0.002","17.842","0.002","17.29","0.003","90","","90","","120","","4766.6","1.1","223","2","223","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C45 H84 Cd4 I4 N4 P4 -","- C45 H84 Cd4 I4 N4 P4 -","- C135 H252 Cd12 I12 N12 P12 -","3","0.166667","","Harms, Klaus; Merle, Jan; Maichle-Mössmer, Cäciliä; Massa, Werner; Krieger, Matthias","Heterocubane Phosphoraniminato Complexes of Cadmium","Inorganic Chemistry","1998","37","5","1099","1104","10.1021/ic9710364","","","0.71073","","","0.04","0.0398","","","0.0971","0.0972","","","","","","1.177","","","","has coordinates","177996","2020-10-21","18:00:00","" "1501513","5.6841","0.0001","5.6841","0.0001","6.98","0.0001","90","","90","","120","","195.303","0.006","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- Mg0.247 Nb0.493 O3 Pb Ti0.26 -","- Mg0.247 Nb0.493 O3 Pb Ti0.26 -","- Mg0.741 Nb1.479 O9 Pb3 Ti0.78 -","3","0.166667","","Singh, Akhilesh Kumar; Pandey, Dhananjai","Evidence for MB and MC phases in the morphotropic phase boundary region of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3: a Rietveld study","Physical Review B","2003","67","6","1","12","10.1103/PhysRev.67.1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "1501514","5.6921","0.0001","5.6921","0.0001","6.9882","0.0002","90","","90","","120","","196.083","0.007","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- Mg0.267 Nb0.533 O3 Pb Ti0.2 -","- Mg0.267 Nb0.533 O3 Pb Ti0.2 -","- Mg0.801 Nb1.599 O9 Pb3 Ti0.6 -","3","0.166667","","Singh, Akhilesh Kumar; Pandey, Dhananjai","Evidence for MB and MC phases in the morphotropic phase boundary region of (1-x)[Pb(Mg1/3Nb2/3)O3]-xPbTiO3: a Rietveld study","Physical Review B","2003","67","6","1","12","10.1103/PhysRev.67.1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "1509267","3.487","","3.487","","20.52","","90","","90","","120","","216.079","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr S2 -","- Ag Cr S2 -","- Ag3 Cr3 S6 -","3","0.166667","","de Lorent, V.; Hahn, H.","Ueber ternaere Chalkogenide des Chroms mit einwertigem Kupfer und Silber","Zeitschrift fuer Anorganische und Allgemeine Chemie","1957","290","","68","81","10.1002/zaac.19572900108","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1509271","3.691","","3.691","","21.22","","90","","90","","120","","250.36","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr Se2 -","- Ag Cr Se2 -","- Ag3 Cr3 Se6 -","3","0.166667","","Hahn, H.; de Lorent, C.","Ueber ternaere Chalkogenide des Chroms mit einwertigem Kupfer und Silber","Zeitschrift fuer Anorganische und Allgemeine Chemie","1957","290","","68","81","10.1002/zaac.19572900108","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1509559","8.645","","8.645","","5.272","","90","","90","","120","","341.221","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Ag Te3 -","- Ag Te3 -","- Ag3 Te9 -","3","0.166667","","von Krziwanik, F.; Zabel, M.; Marx, R.; Panzer, B.; Rau, F.; Range, K.J.","Ein neuer dreidimensionaler Tellur-Bauverband: Hochdrucksynthese und Kristallstruktur von Ag Te3","Angewandte Chemie (German Edition)","1982","94","","717","718","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1510099","3.4823","","3.4823","","21.463","","90","","90","","120","","225.4","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Au (Cr S2)","","- Au Cr S2 -","- Au Cr S2 -","- Au3 Cr3 S6 -","3","0.166667","","Sakashita, S.I.; Fukuoka, H.; Yamanaka, S.","Preparation and structural study of a new ternary gold chromium sulfide, Au Cr S2","Journal of Solid State Chemistry","1999","148","","487","491","10.1006/jssc.1999.8484","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "1514438","32.394","0.006","32.394","0.006","11.017","0.002","90","","90","","120","","10012","3","150","2","150","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C40 H53 Mg N3 O2 -","- C40 H53 Mg N3 O2 -","- C360 H477 Mg9 N27 O18 -","9","0.5","","Baillie, Sharon E.; Blair, Victoria L.; Bradley, Tyne D.; Clegg, William; Cowan, Jemma; Harrington, Ross W.; Hernán-Gómez, Alberto; Kennedy, Alan R.; Livingstone, Zoe; Hevia, Eva","Isomeric and chemical consequences of the direct magnesiation of 1,3-benzoazoles using β-diketiminate-stabilized magnesium bases","Chemical Science","2013","4","4","1895","","10.1039/c3sc22326d","","","0.6889","synchrotron","","0.0759","0.0751","","","0.1859","0.1877","","","","","","1.112","","","","has coordinates","301776","2025-08-18","14:47:46","" "1517183","36.82","","36.82","","11.156","","90","","90","","120","","13098.1","","193","2","193","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","","- C46 H77 N2 O2 S Si2 Y -","- C46 H77 N2 O2 S Si2 Y -","- C414 H693 N18 O18 S9 Si18 Y9 -","9","0.5","","Liu, Bo; Li, Lei; Sun, Guangping; Liu, Jingyao; Wang, Meiyan; Li, Shihui; Cui, Dongmei","3,4-Polymerization of Isoprene by Using NSN- and NPN-Ligated Rare Earth Metal Precursors: Switching of Stereo Selectivity and Mechanism","Macromolecules","2014","47","15","4971","","10.1021/ma501085c","","","0.71073","MoKα","","0.1033","0.0697","","","0.1994","0.21","","","","","","1.062","","","","has coordinates,has disorder","176729","2020-10-21","18:00:00","" "1520923","2.83","","2.83","","20.3727","","90","","90","","120","","141.303","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","H0.19 Na0.06 K0.25 Co O2 (H2 O)0.3","","- Co H0.79 K0.25 Na0.06 O2.3 -","- Co K0.25 Na0.06 O2.3 -","- Co3 K0.75 Na0.18 O6.9 -","3","0.166667","","Butel, M.; Gautier, L.; Delmas, C.","Cobalt oxyhydroxides obtained by 'chimie douce' reactions: structure and electronic conductivity properties","Solid State Ionics","1999","122","","271","284","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1520963","14.262","","14.262","","29.949","","90","","90","","120","","5275.62","","","","","","","","","","","","","16","R 3 m :H","R 3 -2""","160","","Na12 K0.25 Ca6.33 Sr0.72 Ba0.03 Ce0.47 Y0.13 Fe2.55 Mn1.2 Ti0.05 Zr3.27 Nb0.8 Si25.2 O72 (O H)4.69 Cl1.3 (H2 O)0.8","","- Ba0.03 Ca6.33 Ce0.47 Cl1.3 Fe2.55 H6.29 K0.25 Mn1.2 Na12 Nb0.8 O77.49 Si25.2 Sr0.72 Ti0.05 Y0.13 Zr3.27 -","- Ba0.033 Ca6.333 Ce0.468 Cl1.3 Fe2.55 K0.249 Mn1.197 Na12 Nb0.8 O77.49 Si25.2 Sr0.717 Ti0.051 Y0.132 Zr3.27 -","- Ba0.099 Ca18.999 Ce1.404 Cl3.9 Fe7.65 K0.747 Mn3.591 Na36 Nb2.4 O232.47 Si75.6 Sr2.151 Ti0.153 Y0.396 Zr9.81 -","3","0.166667","","Ekimenkova, I.A.; Rastsvetaeva, R.K.; Khomyakov, A.P.","Crystal structure of the Fe, Cl - analogue of kentbrooksite","Doklady Akad. Nauk","2000","370","","477","480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521263","5.739","","5.739","","14.1339","","90","","90","","120","","403.149","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb (Zr0.4 Ti0.6) O3","","- O3 Pb Ti0.6 Zr0.4 -","- O3 Pb Ti0.6 Zr0.4 -","- O9 Pb3 Ti1.8 Zr1.2 -","3","0.166667","","Joseph, J.; Sivasubramanian, V.; Vimala, T.M.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521266","5.7651","","5.7651","","14.184","","90","","90","","120","","408.266","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb (Zr0.53 Ti0.47) O3","","- O3 Pb Ti0.47 Zr0.53 -","- O3 Pb Ti0.47 Zr0.53 -","- O18 Pb6 Ti2.82 Zr3.18 -","6","0.333333","","Joseph, J.; Vimala, T.M.; Sivasubramanian, V.; Murthy, V.R.K.","Structural investigations on Pb (Zrx Ti1-x) O3 solid solutions using the X-ray Rietveld method","Journal of Materials Science","2000","35","","1571","1575","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521711","3.2624","","3.2624","","17.981","","90","","90","","120","","165.737","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(Mo0.4 Nb0.6) S2","","- Mo0.4 Nb0.6 S2 -","- Mo0.4 Nb0.6 S2 -","- Mo1.2 Nb1.8 S6 -","3","0.166667","","Kalikhman, V.L.; Golubnichaya, A.A.","Structure of intermediate phases in quasibinary systems of disulfides of W, Mo, and Nb","Kristallografiya","1983","28","","801","802","","","","","","","","","","","","","","","","","","","","","","has coordinates","141925","2020-10-21","18:00:00","" "1521745","5.7644","","5.7644","","7.0859","","90","","90","","120","","203.908","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb (Sc0.48 Nb0.52) O3","","- Nb0.52 O3 Pb Sc0.48 -","- Nb0.52 O3 Pb Sc0.48 -","- Nb1.56 O9 Pb3 Sc1.44 -","3","0.166667","","Perrin, C.; Menguy, N.; Suard, E.; Muller, C.; Caranoni, C.; Stepanov, A.","Neutron diffraction study of the relaxor-ferroelectric phase transition in disordered Pb (Sc1/2 Nb1/2) O3","Journal of Physics: Condensed Matter","2000","12","","7523","7539","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521757","7.3502","","7.3502","","10.3873","","90","","90","","120","","485.995","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(Cu Cl) (Cu2 (Te S3))","","- Cl Cu3 S3 Te -","- Cl1.001 Cu3 S3 Te -","- Cl3.003 Cu9 S9 Te3 -","3","0.166667","","Pfitzner, A.; Reiser, S.; Nilges, T.; Kockelmann, W.","Composite copper chalcogenide halides: neutron powder diffraction of Cu Cl Cu2 Te S3 and electrical properties of Cu Cl Cu2 Te S3, (Cu I)2 Cu3 Sb S3, and (Cu I)3 Cu2 Te S3","Journal of Solid State Chemistry","1999","147","","170","176","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1521821","14.255","","14.255","","30.17","","90","","90","","120","","5309.34","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","Ca6 Zr3 (Si1.2 Mn0.22 Nb0.58) (Fe2.11 Ti0.05 Zr0.05 Hf0.05) (Na10.57 Ca3.15 Ce0.08) (Si24 O72) O1.71 (O H)2.44 Cl0.21 (H2 O)3.05","","- Ca9.15 Ce0.08 Cl0.21 Fe2.11 H8.54 Hf0.05 Mn0.22 Na10.57 Nb0.58 O79.2 Si25.2 Ti0.05 Zr3.05 -","- Ca9.15 Ce0.081 Cl0.21 Fe2.109 Hf0.0501 Mn0.223 Na10.569 Nb0.58 O79.2 Si25.197 Ti0.0501 Zr3.0501 -","- Ca27.45 Ce0.243 Cl0.63 Fe6.327 Hf0.1503 Mn0.669 Na31.707 Nb1.74 O237.6 Si75.591 Ti0.1503 Zr9.1503 -","3","0.166667","","Rastsvetaeva, R.K.; Ekimenkova, I.A.; Pekov, I.V.","Crystal structure of a new Ca-rich analog of eudialyte","Doklady Akad. Nauk","1999","368","","636","638","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1522189","3.966","","3.966","","9.931","","90","","90","","120","","135.279","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(Bi La2) O4.5","","- Bi La2 O4.5 -","- Bi0.999 La2.001 O4.5 -","- Bi0.999 La2.001 O4.5 -","1","0.0555556","","Wolcyrz, M.; Horyn, R.; Bouree, F.","Structural peculiarities of Bi La2 O4.5+d examined by X-ray and neutron powder diffraction","Journal of Physics: Condensed Matter","1999","11","","5757","5765","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1523416","6.14","","6.14","","37.281","","90","","90","","120","","1217.18","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Al3.1 Ba5 Cu1.9 -","- Al3.1 Ba5 Cu1.9 -","- Al9.3 Ba15 Cu5.7 -","3","0.166667","","Cordier, G.; Roehr, C.","Zur Kenntnis der ternaeren Aluminide Ba5 Cu1.9 Al3.1, Ba16 Ag7 Al27 und Ba3 Ag14.6 Al6.4","Journal of the Less-Common Metals","1991","170","","333","357","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1524107","6.092","","6.092","","8.173","","90","","90","","120","","262.683","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Rb (Cl O3)","","- Cl O3 Rb -","- Cl O3 Rb -","- Cl3 O9 Rb3 -","3","0.166667","","Brunton, G.","The absolute configuration of Rb Cl O3","Materials Research Bulletin","1973","8","","791","794","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08","" "1524802","6.035","","6.035","","20.52","","90","","90","","120","","647.236","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(K5 Y (Mo O4)4)1.5","","- K7.5003 Mo2.0001 O24.0003 Y1.5 -","- K7.5003 Mo2.0001 O24.0003 Y1.5 -","- K7.5003 Mo2.0001 O24.0003 Y1.5 -","1","0.0555556","","Lazoryak, B.I.; Efremov, V.A.","Structural characteristics of K5 Y (Mo O4)4-alpha crystals","Kristallografiya","1981","26","","464","472","","","","","","","","","","","","","","","","","","","","","","has coordinates","145644","2020-10-21","18:00:00","" "1525005","15.997","","15.997","","7.287","","90","","90","","120","","1614.94","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","Na0.84 Ca0.16 Mg2.80 Cr2.18 Al3.92 (B O3)3 (O H)4 (Si6 O18)","","- Al3.92 B3 Ca0.16 Cr2.18 H4 Mg2.8 Na0.84 O31 Si6 -","- Al3.924 B3 Ca0.16 Cr2.178 Mg2.898 Na0.84 O31 Si6 -","- Al11.772 B9 Ca0.48 Cr6.534 Mg8.694 Na2.52 O93 Si18 -","3","0.166667","","Nuber, B.; Schmetzer, K.","Die Gitterposition des Cr(+3) im Turmalin: Strukturverfeinerung eines Cr-reichen Mg-Al-Turmalin","Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-)","1979","137","","184","197","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1525006","15.875","","15.875","","7.126","","90","","90","","120","","1555.26","","","","","","","","","","","","","7","R 3 m :H","R 3 -2""","160","","(Ca0.65 Na0.35) (Li1.40 Al1.6) Al6 F0.85 (O H)3.15 (B O3)3 (Si6 O18)","","- Al7.599 B3 Ca0.65 Li1.401 Na0.35 O30.15 Si6 -","- Al7.599 B3 Ca0.65 Li1.401 Na0.35 O30.15 Si6 -","- Al22.797 B9 Ca1.95 Li4.203 Na1.05 O90.45 Si18 -","3","0.166667","","Nuber, B.; Schmetzer, K.","Strukturverfeinerung von Liddicoatit","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1981","1981","","215","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","145894","2020-10-21","18:00:00","" "1525220","15.967","","15.967","","7.213","","90","","90","","120","","1592.55","","","","","","","","","","","","","8","R 3 m :H","R 3 -2""","160","","Na0.33 Ca0.67 Mg3.53 Al5.47 (B O3)3 (Si6 O18) O0.1 (O H)3.9","","- Al5.47 B3 Ca0.67 H3.9 Mg3.53 Na0.33 O31 Si6 -","- Al5.472 B3 Ca0.67 Mg3.528 Na0.33 O31 Si6 -","- Al16.416 B9 Ca2.01 Mg10.584 Na0.99 O93 Si18 -","3","0.166667","","Schmetzer, K.; Abraham, K.; Nuber, B.","Zur Kristallchemie magnesium-reicher Turmaline","Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-)","1979","136","","93","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1525221","15.923","","15.923","","7.201","","90","","90","","120","","1581.15","","","","","","","","","","","","","8","R 3 m :H","R 3 -2""","160","","Na0.65 Ca0.27 Mg2.64 Al6.36 (B O3)3 (Si6 O18) O0.5 (O H)3.5","","- Al6.36 B3 Ca0.27 H3.5 Mg2.64 Na0.65 O31 Si6 -","- Al6.36 B3 Ca0.27 Mg2.64 Na0.65 O31 Si6 -","- Al19.08 B9 Ca0.81 Mg7.92 Na1.95 O93 Si18 -","3","0.166667","","Schmetzer, K.; Nuber, B.; Abraham, K.","Zur Kristallchemie magnesium-reicher Turmaline","Neues Jahrbuch fuer Mineralogie. Abhandlungen (Band-Nr) (1950-)","1979","136","","93","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1525528","3.482","","3.482","","18.686","","90","","90","","120","","196.202","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Cu Cr S2","","- Cr Cu S2 -","- Cr Cu S2 -","- Cr3 Cu3 S6 -","3","0.166667","","le Nagard, N.; Collin, G.; Gorochov, O.","Etude structurale et proprietes physiques de Cu Cr S2","Materials Research Bulletin","1979","14","","1411","1417","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1525953","14.245","","14.245","","29.959","","90","","90","","120","","5264.81","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","(Ca4.85 Mn0.85 La0.3) Zr3 (Si1.3 Nb0.7) (Fe1.983 Mn0.67 Ti0.192 Zr0.105 Hf0.045) (Sr1.80 Na12.96 K0.24) (Si24 O72) (O H)3.92 Cl1.1 (H2 O)1.1","","- Ca4.85 Cl1.1 Fe1.983 H6.12 Hf0.045 K0.24 La0.3 Mn1.52 Na12.96 Nb0.7 O77.02 Si25.3 Sr1.8 Ti0.192 Zr3.105 -","- Ca4.8498 Cl1.1 Fe1.983 Hf0.045 K0.24 La0.3 Mn1.5222 Na12.96 Nb0.7 O77.02 Si25.3 Sr1.8 Ti0.192 Zr3.105 -","- Ca14.5494 Cl3.3 Fe5.949 Hf0.135 K0.72 La0.9 Mn4.5666 Na38.88 Nb2.1 O231.06 Si75.9 Sr5.4 Ti0.576 Zr9.315 -","3","0.166667","","Ekimenkova, I.A.; Rastsvetaeva, R.K.; Khomyakov, A.P.","Refinement of the crystal structure of a Fe,Sr - analog of kentbrooksite","Kristallografiya","2000","45","","1010","1013","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1526324","14.222","","14.222","","30.165","","90","","90","","120","","5283.91","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","Zr3 (Ca2.7 Mn Fe Na0.846 Ce0.33 Sr0.12) (Si0.96 Al0.52 Ti0.3 Nb0.2) (Zr1.2 Fe0.302 Na16.707 K0.3 Sr0.333) (Si24 O72) O1.17 (O H)3.31 Cl0.53 (H2 O)0.98","","- Al0.52 Ca2.7 Ce0.33 Cl0.53 Fe1.302 H5.27 K0.3 Mn Na17.553 Nb0.2 O77.46 Si24.96 Sr0.453 Ti0.3 Zr4.2 -","- Al0.52 Ca2.7 Ce0.33 Cl0.53 Fe1.302 K0.3 Mn1.002 Na17.553 Nb0.2 O77.46 Si24.96 Sr0.453 Ti0.3 Zr4.2 -","- Al1.56 Ca8.1 Ce0.99 Cl1.59 Fe3.906 K0.9 Mn3.006 Na52.659 Nb0.6 O232.38 Si74.88 Sr1.359 Ti0.9 Zr12.6 -","3","0.166667","","Rastsvetaeva, R.K.; Khomyakov, A.P.","Crystal structure of a hyperzirconium analog of eudialyte","Kristallografiya","2000","45","","251","253","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1526330","14.249","","14.249","","60.969","","90","","90","","120","","10720.3","","","","","","","","","","","","","16","R 3 m :H","R 3 -2""","160","","(Na27.31 Sr0.47) K7.68 (Ca11.67 Sr0.3 Ce0.03) (Fe2.19 Mn0.36) (Zr5.34 Ti0.6 Hf0.06) (Si51.51 Nb0.1 Al0.19) O145.29 Cl2.43 (O H)3.17 (H2 O)2.34","","- Al0.19 Ca11.67 Ce0.03 Cl2.43 Fe2.19 H7.85 Hf0.06 K7.68 Mn0.36 Na27.31 Nb0.1 O150.8 Si51.51 Sr0.77 Ti0.6 Zr5.34 -","- Al0.19 Ca11.664 Ce0.036 Cl2.43 Fe2.19 Hf0.06 K7.68 Mn0.36 Na27.312 Nb0.1 O150.8 Si51.51 Sr0.768 Ti0.6 Zr5.34 -","- Al0.57 Ca34.992 Ce0.108 Cl7.29 Fe6.57 Hf0.18 K23.04 Mn1.08 Na81.936 Nb0.3 O452.4 Si154.53 Sr2.304 Ti1.8 Zr16.02 -","3","0.166667","","Rastsvetaeva, R.K.; Khomyakov, A.P.","Modulated structure of a potassium-rich analog of eudialyte with a doubled parameter c","Kristallografiya","2001","46","","715","721","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1526456","5.6618","","5.6618","","6.9407","","90","","90","","120","","192.683","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb ((Fe Ta) O6)0.5","","- Fe0.5 O3 Pb Ta0.5 -","- Fe0.5 O3 Pb Ta0.5 -","- Fe1.5 O9 Pb3 Ta1.5 -","3","0.166667","","Ivanov, S.A.; Eriksson, S.; Thomas, N.W.; Tellgren, R.; Rundlof, H.","A neutron powder diffraction study of the ferroelectric relaxor Pb (Fe1/2 Ta1/2) O3","Journal of Physics: Condensed Matter","2001","13","","25","33","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1527069","3.972","","3.972","","20.34","","90","","90","","120","","277.907","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","((Fe0.28 Ni0.28) Te0.44)13.6","","- Fe3.808 Ni3.808 Te5.984 -","- Fe3.789 Ni3.789 Te6 -","- Fe3.789 Ni3.789 Te6 -","1","0.0555556","","Akesson, G.; Rost, E.","The crystal structure of Fe0.28 Ni0.28 Te0.44","Acta Chemica Scandinavica (1-27,1973-42,1988)","1973","27","","79","84","","","","","","","","","","","","","","","","","","","","","","has coordinates","148367","2020-10-21","18:00:00","" "1527148","24.817","","24.817","","4.4279","","90","","90","","120","","2361.71","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(Sb I3) (S8)3","","- I3 S24 Sb -","- I3 S24 Sb -","- I9 S72 Sb3 -","3","0.166667","","Bjorvatten, T.; Lindheim, A.; Hassel, O.","Crystal structure of the addition compound Sb I3:3 S8","Acta Chemica Scandinavica (1-27,1973-42,1988)","1963","17","","689","702","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1527527","9.87","","9.87","","7.094","","90","","90","","120","","598.489","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Tl3 (As Se3)","","- As Se3 Tl3 -","- As Se3 Tl3 -","- As3 Se9 Tl9 -","3","0.166667","","Hong, H.Y.-P.; Mikkelsen, J.C.Jr.; Roland, G.W.","Crystal structure of Tl3 As Se3","Materials Research Bulletin","1974","9","","365","370","","","","","","","","","","","","","","","","","","","","","","has coordinates","301777","2025-08-18","15:08:08","" "1527926","4.21","","4.21","","61","","90","","90","","120","","936.321","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ge3 Bi2 Te6","","- Bi2 Ge3 Te6 -","- Bi2 Ge3 Te6 -","- Bi6 Ge9 Te18 -","3","0.166667","","Petrov, I.I.; Imamov, R.M.","Crystal structure determination for Ge3 Bi2 Te6","Kristallografiya","1970","15","","168","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","149738","2020-10-21","18:00:00","" "1528147","3.42","","3.42","","137.7","","90","","90","","120","","1394.82","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Ti9.2 S16","","- S16 Ti9.2 -","- S16 Ti9.2 -","- S48 Ti27.6 -","3","0.166667","","Tronc, E.; Huber, M.","Polytypisme dans le systeme titane-soufre","Journal of Physics and Chemistry of Solids","1973","34","","2045","2058","","","","","","","","","","","","","","","","","","","","","","has coordinates","150091","2020-10-21","18:00:00","" "1528187","18.91","","18.91","","5.302","","90","","90","","120","","1641.93","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","S3 N5 P F2","","- F2 N5 P S3 -","- F2 N5 P S3 -","- F18 N45 P9 S27 -","9","0.5","","Weiss, J.; Appel, R.; Ruppert, I.","Die Kristall- und Molekuelstruktur von S3 N5 P F2","Zeitschrift fuer Anorganische und Allgemeine Chemie","1974","406","","329","336","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1528775","4.05","","4.05","","28.77","","90","","90","","120","","408.677","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- In2 Se3 -","- In2 Se3 -","- In6 Se9 -","3","0.166667","","Osamura, K.; Murakami, Y.; Tomiie, Y.","Crystal Structures of alpha and beta- indium selenide, = In2 Se3","Journal of the Physical Society of Japan","1966","21","","1848","1848","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1528898","3.32169","","3.32169","","40.9479","","90","","90","","120","","391.274","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Zr2 Al4 C5","","- C5 Al4 Zr2 -","- C5 Al4 Zr2 -","- C15 Al12 Zr6 -","3","0.166667","","Sugiura, K.; Iwata, T.; Yoshida, H.; Hashimoto, S.; Fukuda, K.","Synthesis, crystal structures and Si solubilities of new layered carbides Zr2 Al4 C5 and Zr3 Al4 C6","Journal of Solid State Chemistry","2008","181","","2864","2868","","","","","","","","","","","","","","","","","","","","","","has coordinates","151712","2020-10-21","18:00:00","" "1528899","3.31807","","3.31807","","48.9771","","90","","90","","120","","466.976","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Zr3 Al4 C6","","- C6 Al4 Zr3 -","- C6 Al4 Zr3 -","- C18 Al12 Zr9 -","3","0.166667","","Sugiura, K.; Iwata, T.; Yoshida, H.; Hashimoto, S.; Fukuda, K.","Synthesis, crystal structures and Si solubilities of new layered carbides Zr2 Al4 C5 and Zr3 Al4 C6","Journal of Solid State Chemistry","2008","181","","2864","2868","","","","","","","","","","","","","","","","","","","","","","has coordinates","151713","2020-10-21","18:00:00","" "1528933","3.292","","3.292","","19.392","","90","","90","","120","","182.001","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Mo Se2 -","- Mo Se2 -","- Mo3 Se6 -","3","0.166667","","Towle, L.C.; Oberbeck, V.; Stajdohar, R.E.; Brown, B.E.","Molybdenum Diselenide: Rhombohedral High Pressure - High Temperature Polymorph","Science","1966","154","","895","896","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1529124","2.831","","2.831","","16.53","","90","","90","","120","","114.732","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Na.60 Co O2","","- Co Na0.6 O2 -","- Co Na0.6 O2 -","- Co3 Na1.8 O6 -","3","0.166667","","Fouassier, C.; Matejka, G.; Reau, J.M.; Hagenmuller, P.","Sur de Nouveaux Bronzes Oxygenes de Formule Nax Co O2 (x below or equal to 1). Le Systeme Cobalt-Oxygene-Sodium","Journal of Solid State Chemistry","1973","6","","532","537","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1529514","3.48","","3.48","","20.55","","90","","90","","120","","215.527","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Na0.7 Cr0.7 Ti0.3 S2","","- Cr0.7 Na0.7 S2 Ti0.3 -","- Cr0.7 Na0.7 S2 Ti0.3 -","- Cr2.1 Na2.1 S6 Ti0.9 -","3","0.166667","","Abou Ghaloun, O.; Rouxel, J.; Chevalier, P.; Trichet, L.","Structural, electrical, magnetic and NMR study of the Nax Crx Ti(1-x) S2 system","Solid State Ionics","1981","2","","231","235","","","","","","","","","","","","","","","","","","","","","","has coordinates","153946","2020-10-21","18:00:00","" "1530653","3.538","","3.538","","21.92","","90","","90","","120","","237.622","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Tl Cr S2","","- Cr S2 Tl -","- Cr S2 Tl -","- Cr3 S6 Tl3 -","3","0.166667","","Rosenberg, M.; Knulle, A.; Platte, C.; Sabrowsky, H.","Magnetic properties and structure of some ternary chromium chalcogenides with thallium and silver","Journal of Physics and Chemistry of Solids","1982","43","","87","95","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1530672","3.246","","3.246","","18.077","","90","","90","","120","","164.951","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Mo.5 Ta.5 S2","","- Mo0.5 S2 Ta0.5 -","- Mo0.5 S2 Ta0.5 -","- Mo1.5 S6 Ta1.5 -","3","0.166667","","Saeki, M.; Onoda, M.","Preparation of 3s-type Mo.5 Ta.5 S2","Journal of the Less-Common Metals","1987","135","","1","3","","","","","","","","","","","","","","","","","","","","","","has coordinates","155811","2020-10-21","18:00:00","" "1530902","3.382","","3.382","","19.38","","90","","90","","120","","191.969","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Zr Cl2","","- Cl2 Zr -","- Cl2 Zr -","- Cl6 Zr3 -","3","0.166667","","Troyanov, S.I.; Tsyrelnikov, V.I.","Synthesis and investigation of structure of zirconium dichloride","Vestnik Moskovskogo Universiteta, Khimiya","1973","14","","67","71","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1531361","14.248","","14.248","","30.02199","","90","","90","","120","","5278.1","","","","","","","","","","","","","8","R 3 m :H","R 3 -2""","160","","Na12 Ca6 Fe3 Zr3 (Si24 O66) (O H)5 Cl","","- Ca6 Cl Fe3 H5 Na12 O71 Si24 Zr3 -","- Ca6 Cl Fe3 Na12 O71 Si24.0001 Zr3 -","- Ca18 Cl3 Fe9 Na36 O213 Si72.0003 Zr9 -","3","0.166667","","Golyshev, V.M.; Simonov, V.I.; Belov, N.V.","Crystal structure of eudialyte","Kristallografiya","1972","17","","1119","1123","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1531368","15.9456","","15.9456","","7.1384","","90","","90","","120","","1571.86","","","","","","","","","","","","","11","R 3 m :H","R 3 -2""","160","","(Na0.8 Ca0.01) (Al1.28 Mn1.21 Li0.37 Fe0.021) Al6 ((Si5.8 Al0.2) O18) (B O3)3 ((O H)3.25 F0.43 O0.32)","","- Al7.48 B3 Ca0.01 F0.43 Fe0.021 H3.25 Li0.37 Mn1.21 Na0.8 O30.57 Si5.8 -","- Al7.479 B3 Ca0.01 F0.43 Fe0.021 H3 Li0.369 Mn1.209 Na0.8 O30.57 Si5.802 -","- Al22.437 B9 Ca0.03 F1.29 Fe0.063 H9 Li1.107 Mn3.627 Na2.4 O91.71 Si17.406 -","3","0.166667","","Ertl, A.; Hughes, J.M.; Prowatke, S.; Fritz, E.A.; Rossman, G.R.; London, D.","Mn-rich tourmaline from Austria: structure, chemistry, optical spectra and relations to synthetic solid solutions","American Mineralogist","2003","88","","1369","1376","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1531370","15.941","","15.941","","7.136","","90","","90","","120","","1570.42","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","(Na0.77 Ca0.03) (Al1.23 Mn1.14 Li0.48 Fe0.02 Ti0.01) Al6 ((Si5.83 Al0.17) O18) (B O3)3 ((O H)3.33 F0.48 O0.19)","","- Al7.4 B3 Ca0.03 F0.48 Fe0.02 H3.33 Li0.48 Mn1.14 Na0.77 O30.52 Si5.83 Ti0.01 -","- Al7.3998 B3 Ca0.03 F0.48 Fe0.0201 H3 Li0.48 Mn1.14 Na0.77 O30.52 Si5.8302 Ti0.0099 -","- Al22.1994 B9 Ca0.09 F1.44 Fe0.0603 H9 Li1.44 Mn3.42 Na2.31 O91.56 Si17.4906 Ti0.0297 -","3","0.166667","","Ertl, A.; Fritz, E.A.; Hughes, J.M.; Rossman, G.R.; London, D.; Prowatke, S.","Mn-rich tourmaline from Austria: structure, chemistry, optical spectra and relations to synthetic solid solutions","American Mineralogist","2003","88","","1369","1376","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1531372","15.951","","15.951","","7.164","","90","","90","","120","","1578.56","","","","","","","","","","","","","14","R 3 m :H","R 3 -2""","160","","(Na0.64 Ca0.1 K0.06) (Fe1.72 Al1.08 Ti0.11 Zn0.03) (Al5.7 Mg0.198 Fe0.08 Mn0.018) (B O3)3 ((Si5.76 B0.24) O18) (F0.11 (O H)3.31 O0.58)","","- Al6.78 B3.24 Ca0.1 F0.11 Fe1.8 H3.31 K0.06 Mg0.198 Mn0.018 Na0.64 O30.89 Si5.76 Ti0.11 Zn0.03 -","- Al6.78 B3.24 Ca0.1 F0.11 Fe1.797 H3 K0.06 Mg0.198 Mn0.018 Na0.64 O30.89 Si5.76 Ti0.111 Zn0.03 -","- Al20.34 B9.72 Ca0.3 F0.33 Fe5.391 H9 K0.18 Mg0.594 Mn0.054 Na1.92 O92.67 Si17.28 Ti0.333 Zn0.09 -","3","0.166667","","Ertl, A.; Hughes, J.M.","The crystal structure of an aluminum-rich schorl overgrown by boron-rich olenite from Koralpe, Styria, Austria","Mineralogy and Petrology","2002","75","","69","78","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1531994","15.9856","","15.9856","","7.1892","","90","","90","","120","","1591","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","(Na0.78 Ca0.14) (Fe2.3 Mg0.7) (Al5.59 Mg0.41) (Si6 O18) (B O3)3 (O H)4","","- Al5.59 B3 Ca0.14 Fe2.3 H4 Mg1.11 Na0.78 O31 Si6 -","- Al5.5902 B3 Ca0.14 Fe2.301 Mg1.1088 Na0.78 O31 Si6 -","- Al16.7706 B9 Ca0.42 Fe6.903 Mg3.3264 Na2.34 O93 Si18 -","3","0.166667","","Ondrus, P.; Vrana, S.; Maslan, M.","Chemical composition and crystal structure refinement of schorl from the Lundazi pegmatite field, Zambia","Bulletin of the Czech Geological Survey","2002","77","","23","28","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1532779","5.7414","","5.7414","","7.0317","","90","","90","","120","","200.737","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Ba ((Fe0.5 Ta0.5) O3)","","- Ba Fe0.5 O3 Ta0.5 -","- Ba Fe0.5 O3 Ta0.5 -","- Ba3 Fe1.5 O9 Ta1.5 -","3","0.166667","","Li Guobao; Lin Jianhua; Liao Fuhui; Tian Shujian; Liu Shixiang; Kohn, K.; Jing Xiping; Uesu, Y.; Cheng Zhaohua; Saitoh, K.; Terauchi, M.; Di Nai-Li","The structural and electric properties of the perovskite system (Ba Ti O3) - (Ba (Fe0.5 Ta0.5) O3)","Journal of Solid State Chemistry","2004","177","","1695","1703","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533706","5.529","","5.529","","6.6849","","90","","90","","120","","176.978","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(La0.82 Sr0.17) Mn O3.021","","- La0.82 Mn O3.021 Sr0.17 -","- La0.82 Mn O3.021 Sr0.17 -","- La2.46 Mn3 O9.063 Sr0.51 -","3","0.166667","","Belous, A.G.; Pashkova, E.V.; V'yunov, O.I.; Yanchevskii, O.Z.; Tovstolytkin, A.I.; Pogorelyi, A.M.","Effects of chemical composition and sintering temperature on the structure of La1-x Srx Mn O3+d solid solutions","Neorganicheskie Materialy","2003","39","","212","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533714","5.5376","","5.5376","","6.6872","","90","","90","","120","","177.59","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(La0.83 Sr0.17) Mn O3.068","","- La0.83 Mn O3.068 Sr0.17 -","- La0.83 Mn O3.069 Sr0.17 -","- La2.49 Mn3 O9.207 Sr0.51 -","3","0.166667","","Belous, A.G.; V'yunov, O.I.; Pashkova, E.V.; Tovstolytkin, A.I.; Yanchevskii, O.Z.; Pogorelyi, A.M.","Effects of chemical composition and sintering temperature on the structure of La1-x Srx Mn O3+d solid solutions","Neorganicheskie Materialy","2003","39","","212","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533718","5.522","","5.522","","6.6862","","90","","90","","120","","176.564","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(La0.76 Sr0.23) Mn O3.047","","- La0.76 Mn O3.047 Sr0.23 -","- La0.76 Mn O3.048 Sr0.23 -","- La2.28 Mn3 O9.144 Sr0.69 -","3","0.166667","","Belous, A.G.; V'yunov, O.I.; Tovstolytkin, A.I.; Pashkova, E.V.; Yanchevskii, O.Z.; Pogorelyi, A.M.","Effects of chemical composition and sintering temperature on the structure of La1-x Srx Mn O3+d solid solutions","Neorganicheskie Materialy","2003","39","","212","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533722","5.4941","","5.4941","","6.6711","","90","","90","","120","","174.39","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(La0.69 Sr0.3) Mn O3.054","","- La0.69 Mn O3.054 Sr0.3 -","- La0.69 Mn O3.054 Sr0.3 -","- La2.07 Mn3 O9.162 Sr0.9 -","3","0.166667","","Belous, A.G.; Yanchevskii, O.Z.; V'yunov, O.I.; Pashkova, E.V.; Tovstolytkin, A.I.; Pogorelyi, A.M.","Effects of chemical composition and sintering temperature on the structure of La1-x Srx Mn O3+d solid solutions","Neorganicheskie Materialy","2003","39","","212","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533726","5.485","","5.485","","6.67","","90","","90","","120","","173.784","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(La0.7 Sr0.3) Mn O3.054","","- La0.7 Mn O3.054 Sr0.3 -","- La0.7 Mn O3.054 Sr0.3 -","- La2.1 Mn3 O9.162 Sr0.9 -","3","0.166667","","Belous, A.G.; V'yunov, O.I.; Yanchevskii, O.Z.; Pashkova, E.V.; Tovstolytkin, A.I.; Pogorelyi, A.M.","Effects of chemical composition and sintering temperature on the structure of La1-x Srx Mn O3+d solid solutions","Neorganicheskie Materialy","2003","39","","212","222","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1533960","6.3396","","6.3396","","7.9242","","90","","90","","120","","275.81","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","K (I O3)","","- I K O3 -","- I K O3 -","- I3 K3 O9 -","3","0.166667","","Kasatani, H.; Katayama, R.; Aoyagi, S.; Yagi, K.; Kuroiwa, Y.; Terauchi, H.","Study of crystal structure at high temperature phase in K I O3 crystal by synchrotron powder X-ray diffraction","Nuclear Instruments and Methods in Physics Research B: Beam Interaction with Materials and Atoms","2003","199","","49","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:09","" "1534015","15.9459","","15.9459","","7.1723","","90","","90","","120","","1579.38","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","(Na0.66 Ca0.18) (Mg2.46 Al0.54) (Al5.64 Mg0.36) (B O3)3 (Si6 O18) ((O H)3.68 F0.12 O0.2)","","- Al6.18 B3 Ca0.18 F0.12 H3.68 Mg2.82 Na0.66 O30.88 Si6 -","- Al6.18 B3 Ca0.18 F0.12 H3 Mg2.82 Na0.66 O30.88 Si6 -","- Al18.54 B9 Ca0.54 F0.36 H9 Mg8.46 Na1.98 O92.64 Si18 -","3","0.166667","","Pertlik, F.; Ertl, A.; Schuster, R.; Brandstaetter, F.; Koerner, W.","Na-rich dravite in the marbles from Friesach, Carinthia, Austria: chemistry and crystal structure","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","2003","2003","","277","288","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1534298","3.496","","3.496","","20.53","","90","","90","","120","","217.301","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr S2 -","- Ag Cr S2 -","- Ag3 Cr3 S6 -","3","0.166667","","Bongers, P.F.; van Bruggen, C.F.; Koopstra, J.; Omloo, W.P.F.A.M.; Wiegers, G.A.; Jellinek, F.","Structures and magnetic properties of some metal(I) chromium(III) sulfides and selenides","Journal of Physics and Chemistry of Solids","1968","29","","977","984","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1534299","3.676","","3.676","","19.37","","90","","90","","120","","226.679","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Cu Cr Se2","","- Cr Cu Se2 -","- Cr Cu Se2 -","- Cr3 Cu3 Se6 -","3","0.166667","","Bongers, P.F.; Jellinek, F.; van Bruggen, C.F.; Koopstra, J.; Omloo, W.P.F.A.M.; Wiegers, G.A.","Structures and Magnetic Properties of Some Metal(I) Chromium(III) Sulfides and Selenides","Journal of Physics and Chemistry of Solids","1968","29","","977","984","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1534300","3.682","","3.682","","21.23","","90","","90","","120","","249.257","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr Se2 -","- Ag Cr Se2 -","- Ag3 Cr3 Se6 -","3","0.166667","","Bongers, P.F.; Omloo, W.P.F.A.M.; van Bruggen, C.F.; Koopstra, J.; Wiegers, G.A.; Jellinek, F.","Structures and Magnetic Properties of Some Metal(I) Chromium(III) Sulfides and Selenides","Journal of Physics and Chemistry of Solids","1968","29","","977","984","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1534648","4","","4","","24.95","","90","","90","","120","","345.717","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- In Se -","- In Se -","- In6 Se6 -","6","0.333333","","Gomez da Costa, P.; Dandrea, R.G.; Wallis, R.F.; Balkanski, M.","First-principles study of the electronic structure of gamma-InSe and beta-InSe","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1993","48","","14135","14141","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1535305","6.991","","6.991","","20.311","","90","","90","","120","","859.687","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Na2 (Ti3 Cl8)","","- Cl8 Na2 Ti3 -","- Cl8 Na2 Ti3 -","- Cl24 Na6 Ti9 -","3","0.166667","","Hinz, D.J.; Dedecke, T.; Meyer, G.; Urland, W.","Natrium-octachlorotrititanat(II), Na2 Ti3 Cl8: Von isolierten (Ti2)+ -Ionen zu (Ti3)6+ -Clustern ?","Angewandte Chemie (Edition international)","1995","34","","71","73","","","","","","","","","","","","","","","","","","","","","","has coordinates","162607","2020-10-21","18:00:00","" "1535328","4.06","","4.06","","20.973","","90","","90","","120","","299.394","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ce Br2 H0.87","","- Br1.94 Ce H -","- Br1.94 Ce H -","- Br5.82 Ce3 H3 -","3","0.166667","","Michaelis, C.; Borrmann, H.; Mattausch, H.J.; Cockcroft, J.K.; Simon, A.","Ln Hal2 Hn - Neue Phasen in den ternaeren Systemen Ln/Hal/H. I. Strukturen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1992","607","","29","33","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1535425","5.619","","5.619","","31.084","","90","","90","","120","","849.935","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Ba.638 Mg.276 Al10.724 O17","","- Al10.724 Ba0.638 Mg0.276 O17 -","- Al10.7118 Ba0.638 Mg0.2882 O17 -","- Al32.1354 Ba1.914 Mg0.8646 O51 -","3","0.166667","","Thomas, J.O.; Alden, M.; Farrington, G.C.","The relationship between structure and ionic conductivity in divalent beta-aluminas","Solid State Ionics","1983","9","","301","306","","","","","","","","","","","","","","","","","","","","","","has coordinates","162804","2020-10-21","18:00:00","" "1535427","5.61","","5.61","","33.967","","90","","90","","120","","925.792","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb0.883 Mg0.766 Al10.234 O17","","- Al10.234 Mg0.766 O17 Pb0.883 -","- Al10.2344 Mg0.7656 O17 Pb0.884 -","- Al30.7032 Mg2.2968 O51 Pb2.652 -","3","0.166667","","Thomas, J.O.; Alden, M.; Farrington, G.C.","The relationship between structure and ionic conductivity in divalent beta-aluminas","Solid State Ionics","1983","9","","301","306","","","","","","","","","","","","","","","","","","","","","","has coordinates","162808","2020-10-21","18:00:00","" "1535429","5.61","","5.61","","33.72","","90","","90","","120","","919.06","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Sr.857 Mg.714 Al10.286 O17","","- Al10.286 Mg0.714 O17 Sr0.857 -","- Al10.2861 Mg0.7139 O17 Sr0.856 -","- Al30.8583 Mg2.1417 O51 Sr2.568 -","3","0.166667","","Thomas, J.O.; Alden, M.; Farrington, G.C.","The relationship between structure and ionic conductivity in divalent beta-aluminas","Solid State Ionics","1983","9","","301","306","","","","","","","","","","","","","","","","","","","","","","has coordinates","162812","2020-10-21","18:00:00","" "1535432","5.613","","5.613","","33.27","","90","","90","","120","","907.765","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Ca.950 Mg.900 Al10.100 O17","","- Al10.1 Ca0.95 Mg0.9 O17 -","- Al10.1002 Ca0.95 Mg0.8998 O17 -","- Al30.3006 Ca2.85 Mg2.6994 O51 -","3","0.166667","","Thomas, J.O.; Alden, M.; Farrington, G.C.","The relationship between structure and ionic conductivity in divalent beta-aluminas","Solid State Ionics","1983","9","","301","306","","","","","","","","","","","","","","","","","","","","","","has coordinates","162816","2020-10-21","18:00:00","" "1535435","5.62","","5.62","","33.146","","90","","90","","120","","906.639","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Cd.971 Mg.942 Al10.058 O17","","- Al10.058 Cd0.971 Mg0.942 O17 -","- Al10.0584 Cd0.969 Mg0.9416 O17 -","- Al30.1752 Cd2.907 Mg2.8248 O51 -","3","0.166667","","Thomas, J.O.; Alden, M.; Farrington, G.C.","The relationship between structure and ionic conductivity in divalent beta-aluminas","Solid State Ionics","1983","9","","301","306","","","","","","","","","","","","","","","","","","","","","","has coordinates","162820","2020-10-21","18:00:00","" "1535438","5.623","","5.623","","33.517","","90","","90","","120","","917.766","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Zn.865 Mg.730 Al10.270 O17","","- Al10.27 Mg0.73 O17 Zn0.865 -","- Al10.2696 Mg0.7304 O17 Zn0.866 -","- Al30.8088 Mg2.1912 O51 Zn2.598 -","3","0.166667","","Thomas, J.O.; Alden, M.; Farrington, G.C.","The relationship between structure and ionic conductivity in divalent beta-aluminas","Solid State Ionics","1983","9","","301","306","","","","","","","","","","","","","","","","","","","","","","has coordinates","162824","2020-10-21","18:00:00","" "1535540","3.16","","3.16","","18.32999","","90","","90","","120","","158.514","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Mo S2 -","- Mo S2 -","- Mo3 S6 -","3","0.166667","","Traill, R.J.","A rhombohedral polytype of molybdenite","Canadian Mineralogist","1962","7","","524","526","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1536059","13.1","","13.1","","7.98","","90","","90","","120","","1185.98","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Li57 Co19.5 O48","","- Co19.5 O48 -","- Co19.5 O48 -","- Co19.5 O48 -","1","0.0555556","","Jansen, M.; Kastner, P.; Hoppe, R.","Zur Kenntnis der Systeme Li2 O/Co O und Li2 O/Zn O","Zeitschrift fuer Anorganische und Allgemeine Chemie","1975","414","","69","75","","","","","","","","","","","","","","","","","","","","","","has coordinates","163640","2020-10-21","18:00:00","" "1536063","13.14","","13.14","","7.99","","90","","90","","120","","1194.73","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Li4 Zn O3","","- O3 Zn0.64125 -","- O3 Zn0.64125 -","- O48 Zn10.26 -","16","0.888889","","Jansen, M.; Hoppe, R.; Kastner, P.","Zur Kenntnis der Systeme Li2 O/Co O und Li2 O/Zn O","Zeitschrift fuer Anorganische und Allgemeine Chemie","1975","414","","69","75","","","","","","","","","","","","","","","","","","","","","","has coordinates","163645","2020-10-21","18:00:00","" "1536215","3.862","","3.862","","19.97499","","90","","90","","120","","258.013","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(Cu5 Fe S4)0.5","","- Cu2.5 Fe0.5 S2 -","- Cu2.499 Fe0.501 S2 -","- Cu7.497 Fe1.503 S6 -","3","0.166667","","Daams, J.L.C.; Villars, P.","Atomic environment classification of the rhombohedral ""intermetallic"" structure types","Journal of Alloys Compd.","1993","201","","11","16","","","","","","","","","","","","","","","","","","","","","","has coordinates","163848","2020-10-21","18:00:00","" "1536455","24.739","","24.739","","4.412","","90","","90","","120","","2338.46","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(As I3) (S8)3","","- As I3 S24 -","- As I3 S24 -","- As3 I9 S72 -","3","0.166667","","Kelly, J.F.; Krausz, E.; Samoc, A.; Samoc, M.; Willis, A.C.","Crystal structure of the second order nonlinear optical addition complex, (As I3) * 3(S8)","Australian Journal of Chemistry","2002","55","","709","714","","","","","","","","","","","","","","","","","","","","","","has coordinates","301778","2025-08-18","15:17:10","" "1536589","11.1455","","11.1455","","17.552","","90","","90","","120","","1888.24","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","((H3 O) (Te3 Cl13)) (S O2)0.5","","- Cl13 H3 O2 S0.5 Te3 -","- Cl13 H3 O1.999 S0.501 Te3 -","- Cl39 H9 O5.997 S1.503 Te9 -","3","0.166667","","Pietikainen, J.; Maaninen, A.; Valkonen, J.; Laitinen, R.S.; Oilunkaniemi, R.","Halogenation of tellurium by S O2 Cl2. Formation and crystal structures of (H3 O) (Te3 Cl13) * 0.5(S O2), ((C4 H8 O)2 H) (Te Cl5) * (C4 H8 O), ((Me2 S O)2 H)2 (Te Cl6) and (Ni (N C C H3)6) (Te2 Cl10)","Polyhedron","2002","21","","1089","1095","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1536844","14.245","","14.245","","30.12","","90","","90","","120","","5293.1","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","Ca6 Zr3 (Si Na Fe1.2 (Zr0.39 Ti0.25 Al0.14 Nb0.05) ((H3 O)7 Na2.8 K2.2) (Si3 O9)2 (Si9 O27)2 (Cl1.5 (O H)6 ))","","- Al0.14 Ca6 Cl1.5 Fe1.2 H27 K2.2 Na3.8 Nb0.05 O85 Si25 Ti0.25 Zr3.39 -","- Al0.144 Ca6 Cl1.47 Fe1.23 K2.22 Na3.82 Nb0.051 O84.97 Si25 Ti0.255 Zr3.39 -","- Al0.432 Ca18 Cl4.41 Fe3.69 K6.66 Na11.46 Nb0.153 O254.91 Si75 Ti0.765 Zr10.17 -","3","0.166667","","Rastsvetaeva, R.K.; Sokolova, M.N.; Borutskii, B.E.","Crystal structure of potassium-oxonic eudialyte","Kristallografiya","1990","35","","1381","1387","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1537382","3.669","","3.669","","19.4","","90","","90","","120","","226.166","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Cu Cr Se2","","- Cr Cu Se2 -","- Cr Cu Se2 -","- Cr3 Cu3 Se6 -","3","0.166667","","Hahn, H.; de Lorent, V.","Ueber ternaere Chalkogenide des Chroms mit einwertigem Kupfer und Silber","Zeitschrift fuer Anorganische und Allgemeine Chemie","1957","290","","68","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1537383","3.492","","3.492","","18.87","","90","","90","","120","","199.274","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Cu Cr S2","","- Cr Cu S2 -","- Cr Cu S2 -","- Cr3 Cu3 S6 -","3","0.166667","","Hahn, H.; de Lorent, V.","Ueber ternaere Chalkogenide des Chroms mit einwertigem Kupfer und Silber","Zeitschrift fuer Anorganische und Allgemeine Chemie","1957","290","","68","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1537648","3.808","","3.808","","45.894","","90","","90","","120","","576.342","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ga In S3 -","- Ga1.002 In0.996 S3 -","- Ga5.01 In4.98 S15 -","5","0.277778","","Amiraslanov, I.R.; Guseinov, G.G.; Kuliev, A.S.; Mamedov, Kh.S.; Amirov, A.S.","Crystal structure of three-packet polytype of Ga In S3","Kristallografiya","1988","33","","767","768","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1538413","7.078","","7.078","","24.94","","90","","90","","120","","1082.05","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ca3 (Si O4) O","","- Ca3 O5 Si -","- Ca3 O4.99667 Si -","- Ca27 O44.97 Si9 -","9","0.5","","O'Daniel, H.; Hellner, E.","Zur Struktur von 3 Ca O. Si O2","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1950","1950","","108","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1538514","7.0363","","7.0363","","17.28188","","90","","90","","120","","740.987","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Ba.95 Al3 (P O4)2 (O H)5 (H2 O)","","- Al3 Ba0.95 H7 O14 P2 -","- Al3 Ba0.95 O14 P2 -","- Al9 Ba2.85 O42 P6 -","3","0.166667","","Radoslovich, E.W.; Slade, P.G.","Pseudo-trigonal symmetry and the structure of Gorceixite","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1980","1980","","157","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1538517","14.245","","14.245","","30.163","","90","","90","","120","","5300.66","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","Na14 Ca6 Zr3 (Fe1.35 Ta0.51) (Si0.78 Nb0.13 W0.09) (Si0.5 Al0.3 Ti0.2) (Si24 O72) (O H)3.52 Cl0.8 (H2 O)1.6","","- Al0.3 Ca6 Cl0.8 Fe1.35 H6.72 Na14 Nb0.13 O77.12 Si25.28 Ta0.51 Ti0.2 W0.09 Zr3 -","- Al0.3 Ca6 Cl0.8 Fe1.35 Na13.98 Nb0.13 O77.09 Si25.28 Ta0.51 Ti0.2 W0.09 Zr3 -","- Al0.9 Ca18 Cl2.4 Fe4.05 Na41.94 Nb0.39 O231.27 Si75.84 Ta1.53 Ti0.6 W0.27 Zr9 -","3","0.166667","","Rastsvetaeva, R.K.; Moekkel, S.; Chukanov, N.V.","Characteristic structural features of a tantalum-rich eudialyte variaty from Brazil","Kristallografiya","2003","48","","250","255","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1539328","3.346","","3.346","","21.02","","90","","90","","120","","203.805","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Na V S2","","- Na S2 V -","- Na S2 V -","- Na3 S6 V3 -","3","0.166667","","Wiegers, G.A.; Kloosterboer, H.J.; van Heiningen, H.; van der Meer, R.; Alberink, A.J.A.","The sodium intercalates of vanadium disulfide and their hydrolysis products","Materials Research Bulletin","1974","9","","1261","1261","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1539728","8.378","","8.378","","10.65","","90","","90","","120","","647.382","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Ge Te -","- Ge Te -","- Ge3 Te3 -","3","0.166667","","Chattopadhyay, T.K.; Boucherle, J.X.; von Schnering, H.G.","Neutron diffraction study on the structural phase transition in Ge Te","Journal of Physics C","1987","20","","1431","1440","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "1539764","3.87","","3.87","","74.15","","90","","90","","120","","961.753","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","In2 (Zn S4)","","- In2 S4 Zn -","- In2 S4 Zn -","- In12 S24 Zn6 -","6","0.333333","","Biyushkina, A.V.; Donika, F.G.; Radautsan, S.I.","Crystal structure of a six-stack polytype Zn In2 S4 (VI)a","Doklady Akademii Nauk SSSR","1989","306","","617","619","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1539815","3.85","","3.85","","46.27","","90","","90","","120","","593.952","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","In2 Zn2 S5","","- In2 S5 Zn2 -","- In2 S5 Zn2 -","- In6 S15 Zn6 -","3","0.166667","","Donika, F.G.; Radautsan, S.I.; Mustya, I.G.; Kiosse, G.A.; Semiletov, S.A.; Donika, T.V.","Crystal structure of the double-pack polytype Zn In2 S4 (II)a, and more careful determination of the structure of the triple-pack polytype Zn In2 S4 (III)a","Soviet Physics, Crystallography (= Kristallografiya)","1971","15","","698","700","","","","","","","","","","","","","","","","","","","","","","has coordinates","168866","2020-10-21","18:00:00","" "1541569","14.252","","14.252","","30.01799","","90","","90","","120","","5280.36","","","","","","","","","","","","","8","R 3 m :H","R 3 -2""","160","","H6 Na12 Ca6 Fe3 Zr3 Si24 O72 Cl2","","- Ca6 Cl2 Fe3 H6 Na12 O72 Si24 Zr3 -","- Ca6 Cl2 Fe3 Na12 O72 Si24 Zr3 -","- Ca18 Cl6 Fe9 Na36 O216 Si72 Zr9 -","3","0.166667","","Golyshev, V.M.; Simonov, V.I.; Belov, N.V.","Crystal Structure of Eudialite","Kristallografiya","1971","16","","93","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1541661","3.08","","3.08","","241.9","","90","","90","","120","","1987.32","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C96 Si96 -","96","5.33333","","Tokonami, M.","The structure determination of the 96R polytype of Si C by a direct method","Mineralogical Journal (Japan)","1966","4","","401","423","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1541720","15.916","","15.916","","7.13","","90","","90","","120","","1564.19","","","","","","","","","","","","","8","R 3 m :H","R 3 -2""","160","","Na0.89 (Li0.4 Mn.9 Al1.7) Al6 (B O3)3 (Si6 O18) O1.1 (O H)2.9","","- Al7.7 B3 H2.9 Li0.4 Mn0.9 Na0.89 O31 Si6 -","- Al7.6821 B3 Li0.3999 Mn0.9 Na0.89 O31 Si6 -","- Al23.0463 B9 Li1.1997 Mn2.7 Na2.67 O93 Si18 -","3","0.166667","","Nuber, B.; Schmetzer, K.","Structural refinement of tsilaisite (manganese tourmaline)","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1984","1984","","301","304","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1542099","5.23","","5.23","","23.81999","","90","","90","","120","","564.255","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Pb2 O (C O3) (H2 O)2","","- C H4 O6 Pb2 -","- C O6 Pb2 -","- C3 O18 Pb6 -","3","0.166667","","Voronova, A.A.; Vainshtein, B.K.","An electron-diffraction study of the crystal structure of Pb C O3 Pb O (H2 O)2","Kristallografiya","1964","9","","197","203","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "1544435","5.7411","0.0006","5.7411","0.0006","7.044","0.0007","90","","90","","120","","201.07","0.04","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","PbZn0.333Nb0.667O3","","","- Nb0.667 O3 Pb Zn0.333 -","- Nb0.6667 O3 Pb0.999 Zn0.3333 -","- Nb2.0001 O9 Pb2.997 Zn0.9999 -","3","0.166667","","Matsushima, Y.; Ishizawa, N.; Wakiya, N.; Mizutani, N.","Structural study of PbZn1/3Nb2/3O3 by single crystal X-ray diffraction an EXAFS","Journal of the Ceramic Society of Japan","2000","108","","617","622","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "1544496","3.31897","0.00002","3.31897","0.00002","46.7309","0.0005","90","","90","","120","","445.801","0.006","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","(ZrC)3Al3[Al0.96Ge0.04]C3","","","- C6 Al3.96 Ge0.04 Zr3 -","- C6 Al3.958 Ge0.042 Zr3 -","- C18 Al11.874 Ge0.126 Zr9 -","3","0.166667","","Sugiura, K.; Iwata, T.; Sunada, N.; Hashimoto, S.; Nakano, H.; Fukuda, K.","Syntheses and crystal structures of Ge-bearing layered carbides Zr2Al4C5 and Zr3Al4C6","Journal of the Ceramic Society of Japan","2009","117","","22","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "1544497","3.32256","0.00002","3.32256","0.00002","40.9434","0.0002","90","","90","","120","","391.435","0.004","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","(ZrC)2Al3[Al0.93Ge0.07]C3","","","- C5 Al3.93 Ge0.07 Zr2 -","- C5 Al3.93 Ge0.07 Zr2 -","- C15 Al11.79 Ge0.21 Zr6 -","3","0.166667","","Sugiura, K.; Iwata, T.; Sunada, N.; Hashimoto, S.; Nakano, H.; Fukuda, K.","Syntheses and crystal structures of Ge-bearing layered carbides Zr2Al4C5 and Zr3Al4C6","Journal of the Ceramic Society of Japan","2009","117","","22","26","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "1544625","15.929","0.0002","15.929","0.0002","7.183","0.0001","90","","90","","120","","1578.39","0.04","","","","","","","","","","","","7","R 3 m :H","R 3 -2""","160","CaFe3Al6(Si5Al)18)(BO3)3(OH)3(OH) adachiite","","adachiite","- Al7 B3 Ca Fe3 H4 O31 Si5 -","- B3 H4 O31 T6 X Y3 Z6 -","- B9 H12 O93 T18 X3 Y9 Z18 -","3","0.166667","","Nishio-Hamane, D.; Minakawa, T.; Yamaura, J.-I.; Oyama, T.; Ohnishi, M.; Shimobayashi, N.","Adachiite, a Si-poor member of the tourmaline supergroup from the Kiura mine, Oita Prefecture, Japan","Journal of Mineralogical and Petrological Sciences","2014","109","","74","78","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "1544862","15.816","0.001","15.816","0.001","7.0944","0.0006","90","","90","","120","","1536.88","0.19","","","","","","","","","","","","7","R 3 m :H","R 3 -2""","160","Na0.70(Li0.60Al2.40)Al6(BO3)3(Si5.58B0.42O18)(OH)3O","","elbaitic tourmaline","- Al8.4 B3.42 H3 Li0.6 Na0.7 O31 Si5.58 -","- Al8.4 B3.42 H3 Li0.6 Na0.7 O31 Si5.58 -","- Al25.2 B10.26 H9 Li1.8 Na2.1 O93 Si16.74 -","3","0.166667","","Sugiyama, K.; Arima, H.; Konno, H.; Kawamata, T.","Distribution of Mn in pink elbaitic tourmaline from Mogok, Myanmar","Journal of Mineralogical and Petrological Sciences","2016","111","","1","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "1544908","15.874","0.003","15.874","0.003","7.116","0.003","90","","90","","120","","1552.9","0.8","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","(Na0.64_0.264)(Al0.415Li0.458)3Al6(BO3)3Si6O18{(OH)0.75F0.179}4","","elbaite","- Al7.2 B3 Ca0.09 F0.72 H3 K0.06 Na0.64 O30 Si6 -","- Al7.245 B3 H3 Li1.374 Na0.64 O31 Si6 -","- Al21.735 B9 H9 Li4.122 Na1.92 O93 Si18 -","3","0.166667","","Kihara, K.; Hirata, H.; Ida, A.; Okudera, H.; Morishita, T.","An X-ray single crystal study of asymmetric thermal vibrations and the positional disorder of atoms in elbaite Refinement type: harmonic","Journal of Mineralogical and Petrological Sciences","2007","102","","115","126","","","","","","","","","","","","","","","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "1545896","12.316","0.008","12.316","0.008","6.115","0.004","90","","90","","120","","803.3","0.9","","","293","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- F15 Pr Zr3 -","- F15 Pr Zr3 -","- F45 Pr3 Zr9 -","3","0.166667","","Laval, J. P.; Abaouz, A.","Crystal chemistry of anion-excess ReO3-related phases : crystal structure of beta-PrZr3F15","Journal of Solid State Chemistry","1992","96","","324","331","10.1016/S0022-4596(05)80266-X","","x-ray","0.71069","MoKα","","","0.033","","","0.033","","","","","","","","","","","has coordinates","195845","2020-10-21","18:00:00","" "1556735","15.955","0.01","15.955","0.01","7.227","0.004","90","","90","","120","","1593.2","1.7","","","298","","","","100","","","","","6","R 3 m :H","R 3 -2""","160","New structure","","maruyamaite, K-rich tourmaline","- Al7 B3 K Mg2 O28 Si6 -","- Al6.099 B3 Ca0.26 Fe0.6 K0.53 Mg2.187 Na0.19 O31 Si5.97 Ti0.141 -","- Al18.297 B9 Ca0.78 Fe1.8 K1.59 Mg6.561 Na0.57 O93 Si17.91 Ti0.423 -","3","0.166667","","Lussier, A.; Ball, N.A.; Hawthorne, F.C.; Henry, D.J.; Shimizu, R.; Ogasawara, Y.; Ota, T.","Maruyamaite, K(MgAl2)(Al5Mg)Si6O18(BO3)3O, a potassium-dominant tourmaline from the ultrahigh-pressure Kokchetav massif, northern Kazakhstan: Description and crystal structure","American Mineralogist","2016","101","","355","361","10.2138/am-2016-5359","","","","","","","","","","","","","","","","","","","","","has coordinates","245578","2020-10-21","18:00:00","" "1556971","16.1908","0.0004","16.1908","0.0004","7.4143","0.0002","90","","90","","120","","1683.21","0.07","","","298","","","","100","","","","","7","R 3 m :H","R 3 -2""","160","NaV3(V4Mg2)(Si6O18)(BO3)3(OH)3O","","oxy-vanadium-dravite","- B3 H4 Mg3 Na O30 Si6 V6 -","- B1.293 H3 Mg2.586 Na1.029 O31 Si2.586 V6.189 -","- B3.879 H9 Mg7.758 Na3.087 O93 Si7.758 V18.567 -","3","0.166667","","Bosi, F.; Reznitskii, L.Z.; Sklyarov, E.V.","Oxy-vanadium-dravite, NaV3(V4Mg2)(Si6O18)(BO3)3(OH)3O: Crystal structure and redefinition of the ""vanadium-dravite"" tourmaline","American Mineralogist","2013","98","","501","505","10.2138/am.2013.4243","","","","","","","","","","","","","","","","","","","","","has coordinates","246651","2020-10-21","18:00:00","" "1556976","15.9853","0.0012","15.9853","0.0012","7.1538","0.0006","90","","90","","120","","1583.1","0.2","","","298","","","","100","","","","","7","R 3 m :H","R 3 -2""","160","Na(Fe2Al)Al6Si6O18(BO3)3(OH)3O","","oxy-schorl","- Al7 B3 Fe2 H3 Na O31 Si6 -","- Al6.981 B3 F0.31 Fe2.019 H3 Na0.676 O30.69 Si6 -","- Al20.943 B9 F0.93 Fe6.057 H9 Na2.028 O92.07 Si18 -","3","0.166667","","Bacik, P.; Cempirek, J.; Uher, P.; Novak, M.; Ozdin, D.; Filip, J.; Skoda, R.; Breiter, K.; Klementova, M.; Duda, R.; Groat, L.A.","Oxy-schorl, Na(Fe2+2Al)Al6Si6O18(BO3)3(OH)3O, a new mineral from Zlata Idka, Slovak Republic and Pribyslavice, Czech Republic : sample from Pribyslavice","American Mineralogist","2013","98","","485","492","10.2138/am.2013.4293","","","","","","","","","","","","","","","","","","","","","has coordinates","246656","2020-10-21","18:00:00","" "1556977","15.916","0.003","15.916","0.003","7.1071","0.0012","90","","90","","120","","1559.2","0.5","","","298","","","","100","","","","","7","R 3 m :H","R 3 -2""","160","Na(Fe2Al)Al6Si6O18(BO3)3(OH)3O","","oxy-schorl","- Al7 B3 Fe2 H3 Na O31 Si6 -","- Al8.151 B3 Fe0.603 Na0.859 O31 Si5.394 -","- Al24.453 B9 Fe1.809 Na2.577 O93 Si16.182 -","3","0.166667","","Bacik, P.; Cempirek, J.; Uher, P.; Novak, M.; Ozdin, D.; Filip, J.; Skoda, R.; Breiter, K.; Klementova, M.; Duda, R.; Groat, L.A.","Oxy-schorl, Na(Fe2+2Al)Al6Si6O18(BO3)3(OH)3O, a new mineral from Zlata Idka, Slovak Republic and Pribyslavice, Czech Republic : sample from Zlata Idka","American Mineralogist","2013","98","","485","492","10.2138/am.2013.4293","","","","","","","","","","","","","","","","","","","","","has coordinates","246657","2020-10-21","18:00:00","" "1557977","15.809","0.002","15.809","0.002","7.089","0.001","90","","90","","120","","1534.3","0.3","","","298","","","","100","","","","","9","R 3 m :H","R 3 -2""","160","(Na0.58Ca0.01)(Li1.05Al1.95)Al6(BO3)3(Si6O18)(OH)3(O0.66F0.34)","","darrellhenryite","- Al7.95 B3 Ca0.01 F0.34 H3 Li1.05 Na0.58 O30.66 Si6 -","- Al7.953 B3 F0.34 H3 Li1.047 Na0.56 O30.66 Si6 -","- Al23.859 B9 F1.02 H9 Li3.141 Na1.68 O91.98 Si18 -","3","0.166667","","Novak, M.; Ertl, A.; Povondra, P.; Galiova, M.V.; Rossman, G.R.; Pristacz, H.; Prem, M.; Giester, G.; Gadas, P.; Skoda, R.","Darrellhenryite, Na(LiAl2)Al6(BO3)3Si6O18(OH)3O, a new mineral from the tourmaline supergroup","American Mineralogist","2013","98","","1886","1892","10.2138/am.2013.4416","","","","","","","","","","","","","","","","","","","","","has coordinates","251349","2020-10-21","18:00:00","" "1562211","10.384","0.0015","10.384","0.0015","3.952","0.0008","90","","90","","120","","369.04","0.11","100","2","100","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C3 H3 Dy O6 -","- C3 H3 Dy O6 -","- C9 H9 Dy3 O18 -","3","0.166667","","Zhang, Yingjie; Bhadbhade, Mohan; Scales, Nicholas; Karatchevtseva, Inna; Price, Jason R.; Lu, Kim; Lumpkin, Gregory R.","Dysprosium complexes with mono-/di-carboxylate ligands—From simple dimers to 2D and 3D frameworks","Journal of Solid State Chemistry","2014","219","","1","8","10.1016/j.jssc.2014.07.007","","","0.7108","Synchrotron","","0.0091","0.0091","","","0.0231","0.0231","","","","","","0.831","","","","has coordinates","264638","2021-04-28","09:37:22","" "1569813","15.8313","0.0002","15.8313","0.0002","7.104","0.0001","90","","90","","120","","1541.94","0.04","293","2","293","2","","","","","","","","10","R 3 m :H","R 3 -2""","160","","","","- Al8.08 B3.51 Ca0.25 F0.07 H3.36 Li0.76 Mn0.16 Na0.42 Oi31 Si5.49 -","- Al6 B3 Ca0.543 F0.586 H3 Li2.328 Mn0.672 Na0.457 Oi30.3961 Si6 -","- Al18 B9 Ca1.629 F1.758 H9 Li6.984 Mn2.016 Na1.371 Oi91.1883 Si18 -","3","0.166667","","Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna","Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar","Crystals","2023","13","8","1290","","10.3390/cryst13081290","","","0.71073","MoKα","","0.017","0.0166","","","0.0407","0.0409","","","","","","1.121","","","","has coordinates","286230","2023-09-06","03:39:08","" "1569814","15.8839","0.0002","15.8839","0.0002","7.116","0.0001","90","","90","","120","","1554.82","0.04","293","2","293","2","","","","","","","","10","R 3 m :H","R 3 -2""","160","","","","- Al8.08 B3.51 Ca0.25 F0.33 H3.36 Li0.76 Mn0.16 Na0.42 O31 Si5.49 -","- Al6 B3 Ca0.33 F0.5948 H3 Li1.869 Mn1.131 Na0.67 O30.4052 Si6 -","- Al18 B9 Ca0.99 F1.7844 H9 Li5.607 Mn3.393 Na2.01 O91.2156 Si18 -","3","0.166667","","Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna","Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar","Crystals","2023","13","8","1290","","10.3390/cryst13081290","","","0.71073","MoKα","","0.0176","0.0175","","","0.0436","0.0437","","","","","","1.129","","","","has coordinates","286231","2023-09-06","03:39:38","" "1569815","15.8345","0.0002","15.8345","0.0002","7.1039","0.0001","90","","90","","120","","1542.54","0.04","293","2","293","2","","","","","","","","10","R 3 m :H","R 3 -2""","160","","","","- Al24.24 B10.53 Ca0.74 F0.2 H10.08 Li2.27 Mn0.49 Na1.26 Oi93 Si16.47 -","- Al18 B9 Ca2.064 F1.7628 H9 Li7.074 Mn1.926 Na0.936 Oi91.2372 Si18 -","- Al18 B9 Ca2.064 F1.7628 H9 Li7.074 Mn1.926 Na0.936 Oi91.2372 Si18 -","1","0.0555556","","Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna","Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar","Crystals","2023","13","8","1290","","10.3390/cryst13081290","","","0.71073","MoKα","","0.0162","0.0161","","","0.0402","0.0403","","","","","","1.129","","","","has coordinates","286232","2023-09-06","03:40:04","" "1569816","15.874","0.0003","15.874","0.0003","7.1138","0.0001","90","","90","","120","","1552.41","0.05","293","2","293","2","","","","","","","","10","R 3 m :H","R 3 -2""","160","","","","- Al8.08 B3.51 Ca0.25 F0.07 H3.36 Li0.76 Mn0.16 Na0.42 Oi31 Si5.49 -","- Al6 B3 Ca0.501 F0.5851 H3 Li1.977 Mn1.023 Na0.499 Oi30.415 Si6 -","- Al18 B9 Ca1.503 F1.7553 H9 Li5.931 Mn3.069 Na1.497 Oi91.245 Si18 -","3","0.166667","","Rizzo, Floriana; Bosi, Ferdinando; Tempesta, Gioacchino; Agrosì, Giovanna","Compositional Variation and Crystal-Chemical Characterization of a Watermelon Variety of Tourmaline from Anjanabonoina, Central Madagascar","Crystals","2023","13","8","1290","","10.3390/cryst13081290","","","0.71073","MoKα","","0.0168","0.0168","","","0.0421","0.0421","","","","","","1.124","","","","has coordinates","286233","2023-09-06","03:40:32","" "1570738","8.4602","0.001","8.4602","0.001","11.0201","0.0016","90","","90","","120","","683.09","0.15","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","Methylammonium tris(iodo)-germanium","","","- C3 H18 Ge3 I9 N3 -","- C2.9997 Ge3 I9 N3 -","- C2.9997 Ge3 I9 N3 -","1","0.0555556","","Morteza Najarian, Amin; Dinic, Filip; Chen, Hao; Sabatini, Randy; Zheng, Chao; Lough, Alan J.; Maris, Thierry; Saidaminov, Makhsud I.; Garcia de Arquer, F. Pelayo; Voznyy, Oleksandr; Hoogland, Sjoerd; Sargent, Edward H.","Homomeric Chains of intermolecular bonds scaffold octahedral germanium perovskites","Nature","2023","620","","328","335","10.1038/s41586-023-06209-y","","","0.71073","MoKα","","0.068","0.0338","","","0.0472","0.0543","","","","","","1.078","","","","has coordinates","288973","2024-01-09","19:19:18","" "2002649","11.4333","0.0006","11.4333","0.0006","3.4949","0.0009","90","","90","","120","","395.6","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Barium niobium(II) diniobium(IV) hexaoxide","","- Ba Nb3 O6 -","- Ba Nb3 O6 -","- Ba3 Nb9 O18 -","3","0.166667","","Moehr, S; Mueller-Buschbaum, Hk","Ueber ein gemischtvalentes Oxoniobat mit planaren Polygonen um Niob und Barium: Ba Nb2+ (Nb4+)2 O6","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1994","49","","915","918","","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","176759","2020-10-21","18:00:00","" "2003109","14.7711","0.0005","14.7711","0.0005","3.82206","0.00006","90","","90","","120","","722.19","0.04","293","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- C10 H15 Li -","- C7.998 Li -","- C23.994 Li3 -","3","0.166667","SE0236","Robert E. Dinnebier","Disorder determined by high-resolution powder diffraction: structure of pentamethylcyclopentadienyllithium","Acta Crystallographica Section B","1999","55","1","35","44","10.1107/S0108768198007009","","","0.84979","synchrotron","","","","","","","","","","","","","","","","","has coordinates","208817","2020-10-21","18:00:00","" "2003323","15.818","0.002","15.818","0.002","7.087","0.001","90","","90","","120","","1535.7","0.3","297","","","","","","","","","","Paraiba, Brazil","6","R 3 m :H","R 3 -2""","160","","","","- Al8 B3 Li Na O31 Si6 -","- Al6 B3 Li3 Na O31 Si6 -","- Al18 B9 Li9 Na3 O93 Si18 -","3","0.166667","BR1070","MacDonald, D. J.; Hawthorne, F. C.","Cu-Bearing Tourmaline from Paraiba, Brazil","Acta Crystallographica Section C","1995","51","4","555","557","10.1107/S0108270194008243","","","0.71073","MoKα","","","0.022","","","0.025","","","","","1.2","1.2","","","","","has coordinates","176435","2020-10-21","18:00:00","" "2003324","15.805","0.002","15.805","0.002","7.084","0.001","90","","90","","120","","1532.5","0.3","297","","","","","","","","","","Paraiba, Brazil","6","R 3 m :H","R 3 -2""","160","","","","- Al8 B3 Li Na O31 Si6 -","- Al6 B3 Li3 Na O31 Si6 -","- Al18 B9 Li9 Na3 O93 Si18 -","3","0.166667","BR1070","MacDonald, D. J.; Hawthorne, F. C.","Cu-Bearing Tourmaline from Paraiba, Brazil","Acta Crystallographica Section C","1995","51","4","555","557","10.1107/S0108270194008243","","","0.71073","MoKα","","","0.02","","","0.023","","","","","1.4","1.4","","","","","has coordinates","176435","2020-10-21","18:00:00","" "2006974","7.885","0.001","7.885","0.001","6.727","0.001","90","","90","","120","","362.21","0.08","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ga3 O7 P -","- Ga3 O7 P -","- Ga9 O21 P3 -","3","0.166667","","Sophie Boudin; Kwang-Hwa Lii","Ga~3~PO~7~","Acta Crystallographica Section C","1998","54","","05","07","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "2015986","15.711","0.007","15.711","0.007","5.792","0.002","90","","90","","120","","1238.1","0.9","298","2","298","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","tripivaloylmethane","4-(2,2-dimethylpropanoyl)-2,2,6,6-tetramethylheptane-3,5-dione","","- C16 H28 O3 -","- C16 H28 O3 -","- C48 H84 O9 -","3","0.166667","GD3098","Branko Kaitner; Vladimir Stilinović","Conformational enantiomeric disorder in tripivaloylmethane","Acta Crystallographica Section C","2007","63","6","o353","o354","10.1107/S0108270107012474","","","0.71073","MoKα","","","0.0749","","","","0.2339","","","","","","1.07","","","","has coordinates","176760","2020-10-21","18:00:00","" "2016801","13.9947","0.0004","13.9947","0.0004","8.4249","0.0003","90","","90","","120","","1428.97","0.08","298","2","298","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Poly[μ~4~-sulfido-tris(thiocyanato-κN)tris(μ~3~-1,2,4-triazolato- κ^3^N^1^:N^2^:N^4^)tetrazinc(II)]","","- C9 H6 N12 S4 Zn4 -","- C9 H6 N12 S4 Zn4 -","- C27 H18 N36 S12 Zn12 -","3","0.166667","GD3237","Park, Hyunsoo; Geiser, Urs; Halder, Gregory J.; Schlueter, John A.","Poly[μ~4~-sulfido-tris(thiocyanato-κN)tris(μ~3~-1,2,4-triazolato-κ^3^N^1^:N^2^:N^4^)tetrazinc(II)]: a three-dimensional zinc sulfide coordination polymer","Acta Crystallographica Section C","2008","64","10","m327","m329","10.1107/S0108270108027327","","","0.71073","MoKα","","0.0143","0.0142","","","0.0343","0.0343","","","","","","1.129","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00","" "2020160","5.07","","5.07","","38.40799","","90","","90","","120","","855.004","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Ba Ce F (C O3)2","","- C2 Ba Ce F O6 -","- C2 Ba Ce F O6 -","- C12 Ba6 Ce6 F6 O36 -","6","0.333333","","Fan, H.-F.; Yao, J.-X.; Main, P.; Woolfson, M.M.","On the application of phase relationships to complex structures. XXIII. Automatic determination of crystal structures having pseudo-translational symmetry by a modified MULTAN procedure","Acta Crystallographica C (39,1983-)","1983","39","","566","569","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2020535","4.4603","0.0003","4.4603","0.0003","18.3197","0.0011","90","","90","","120","","315.63","0.04","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Tetralithium digermanium boride","","- B Ge2 Li4 -","- B Ge2 Li4 -","- B3 Ge6 Li12 -","3","0.166667","","Pavlyuk, Volodymyr; Ciesielski, Wojciech; Rozdzynska-Kielbik, Beata; Dmytriv, Grygoriy; Ehrenberg, Helmut","Li~4~Ge~2~B as a new derivative of the Mo~2~B~5~ and Li~5~Sn~2~ structure types","Acta Crystallographica Section C","2016","72","7","561","565","10.1107/S2053229616009384","","","0.71073","MoKα","","0.0253","0.0223","","","0.0449","0.0469","","","","","","1.039","","","","has coordinates,has Fobs","185016","2020-10-21","18:00:00","" "2101131","13.74","0.02","13.74","0.02","4.82","0.01","90","","90","","120","","788","2","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C9 H15 N3 O3 -","- C12 H12 N6 O6 -","- C36 H36 N18 O18 -","3","0.166667","SE0129","Tereshko, V.; Monserrat, J. M.; Pérez-Folch, J.; Aymamí, J.; Fita, I.; Subirana, J. A.","Structure of the stacked cyclic oligoamides: 1,6-diaza-2,7-cyclodecadione and 1,5,9-triaza-2,6,10-cyclododecatrione. A ring model of the α-helix","Acta Crystallographica, Section B: Structural Science","1994","50","2","243","251","10.1107/S0108768193008924","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","277628","2022-09-05","09:44:05","" "2103389","16.861","","16.861","","5.611","","90","","90","","120","","1381.46","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C15 H21 Ni3 P3 -","- C15 Ni3 P3 -","- C45 Ni9 P9 -","3","0.166667","BK0117","Marsh, Richard E.","The space groups of point group C~3~: some corrections, some comments","Acta Crystallographica Section B","2002","58","5","893","899","10.1107/S0108768102011758","","","","","","","","","","","","","","","","","","","","","has coordinates","208817","2020-10-21","18:00:00","" "2103728","18.704","0.003","18.704","0.003","3.7792","0.0007","90","","90","","120","","1145","0.3","299","1","299","1","","","","","","","","2","R 3 m :H","R 3 -2""","160","","perchlorophenalenyl radical","","- C13 Cl9 -","- C13 Cl9 -","- C39 Cl27 -","3","0.166667","BS0014","Koutentis, P. A.; Haddon, R. C.; Oakley, R. T.; Cordes, A. W.; Brock, C. P.","Perchlorophenalenyl radical, C~13~Cl~9~: a modulated structure with nine threefold-symmetric molecules in the asymmetric unit","Acta Crystallographica Section B","2001","57","5","680","691","10.1107/S0108768101011193","","","0.71073","MoKα","","0.046","0.045","","","","0.14","","","","","","4.08","","","","has coordinates","176768","2020-10-21","18:00:00","" "2104621","5.4698","0.0008","5.4698","0.0008","8.992","0.003","90","","90","","120","","232.99","0.09","298","2","298","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- K N O3 -","- K N O3 -","- K3 N3 O9 -","3","0.166667","BP5023","Freney, Evelyn J.; Garvie, Laurence A. J.; Groy, Thomas L.; Buseck, Peter R.","Growth and single-crystal refinement of phase-III potassium nitrate, KNO~3~","Acta Crystallographica Section B","2009","65","6","659","663","10.1107/S0108768109041019","","","0.71073","MoKα","","0.0224","0.0224","","","0.0544","0.0544","","","","","","1.226","","","","has coordinates","301802","2025-08-19","10:18:49","" "2104622","5.4325","0.0002","5.4325","0.0002","8.8255","0.0007","90","","90","","120","","225.56","0.02","123","2","123","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- K N O3 -","- K N O3 -","- K3 N3 O9 -","3","0.166667","BP5023","Freney, Evelyn J.; Garvie, Laurence A. J.; Groy, Thomas L.; Buseck, Peter R.","Growth and single-crystal refinement of phase-III potassium nitrate, KNO~3~","Acta Crystallographica Section B","2009","65","6","659","663","10.1107/S0108768109041019","","","0.71073","MoKα","","0.0167","0.0167","","","0.041","0.041","","","","","","1.137","","","","has coordinates","176768","2020-10-21","18:00:00","" "2104745","15.9607","0.003","15.9607","0.003","7.19","0.0022","90","","90","","120","","1586.2","0.6","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Foitite","- Al6.89 B3 Fe1.6 Li0.22 Mg0.05 Mn0.24 Na0.25 O31 Si6 -","- Al6.8901 B3 Fe1.5999 Li0.2199 Mg0.0501 Mn0.24 Na0.25 O31 Si6 -","- Al20.6703 B9 Fe4.7997 Li0.6597 Mg0.1503 Mn0.72 Na0.75 O93 Si18 -","3","0.166667","KD5037","Elliot, Alexander Dean","Structure of pyrrhotite 5C (Fe~9~S~10~)","Acta Crystallographica Section B","2010","66","3","271","279","10.1107/S0108768110011845","powder diffraction","","","","","","","","","","","","0.01414","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "2104756","15.9608","0.003","15.9608","0.003","7.19","0.0022","90","","90","","120","","1586.2","0.6","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Foitite","- Al6.89 B3 Fe1.6 Li0.22 Mg0.05 Mn0.24 Na0.25 O31 Si6 -","- Al6.8901 B3 Fe1.5999 Li0.2199 Mg0.0501 Mn0.24 Na0.25 O31 Si6 -","- Al20.6703 B9 Fe4.7997 Li0.6597 Mg0.1503 Mn0.72 Na0.75 O93 Si18 -","3","0.166667","KD5037","Elliot, Alexander Dean","Structure of pyrrhotite 5C (Fe~9~S~10~)","Acta Crystallographica Section B","2010","66","3","271","279","10.1107/S0108768110011845","powder diffraction","","","","","","","","","","","","0.01414","","","","","","","","has coordinates","208816","2020-10-21","18:00:00","" "2105070","8.8349","0.0012","8.8349","0.0012","9.396","0.0016","90","","90","","120","","635.15","0.16","320","0.2","320","0.2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","pyridinium chlorochromate","","- C5 H6 Cl Cr N O3 -","- C4.98 H6 Cl Cr N1.02 O3 -","- C14.94 H18 Cl3 Cr3 N3.06 O9 -","3","0.166667","EB5013","Małuszyńska, Hanna; Czarnecki, Piotr; Czarnecka, Anna; Pajak, Zdzisław","Structures and phase transitions in a new ferroelectric ‒ pyridinium chlorochromate ‒ studied by X-ray diffraction, DSC and dielectric methods","Acta Crystallographica Section B","2012","68","2","128","136","10.1107/S0108768112005782","","","0.71073","MoKα","","0.1015","0.0493","","","0.1056","0.1148","","","","","","0.977","","","","has coordinates,has Fobs","176768","2020-10-21","18:00:00","" "2105347","5.196","","5.196","","8.49","","90","","90","","120","","198.507","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ag (N O3)","","- Ag N O3 -","- Ag N O3 -","- Ag3 N3 O9 -","3","0.166667","","Capponi, J.J.; Meyer, P.","Structure d'une phase 'haute temperature' du nitrate d'argent","Acta Crystallographica B (24,1968-38,1982)","1982","38","","2543","2546","10.1107/S0567740882009352","","","","","","","","","","","","","","","","","","","","","has coordinates","301802","2025-08-19","10:18:51","" "2106552","4","","4","","25.32","","90","","90","","120","","350.844","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- In Se -","- In Se -","- In6 Se6 -","6","0.333333","","Likforman, A.; Carre, D.; Bachet, J.E.; Bachet, B.","Structure cristalline du monoseleniure d'indium In Se","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1252","1254","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "2106968","7.29","","7.29","","27.48","","90","","90","","120","","1264.74","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Cs Mn Cl3","","- Cl3 Cs Mn -","- Cl3 Cs Mn -","- Cl27 Cs9 Mn9 -","9","0.5","","Goodyear, J.; Kennedy, D.J.","The crystal structure of Cs Mn Cl3","Acta Crystallographica B (24,1968-38,1982)","1973","29","","744","748","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2106998","4.24","","4.24","","123.03","","90","","90","","120","","1915.46","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Cd I2 -","- Cd I2 -","- Cd18 I36 -","18","1","","Jain, R.K.; Trigunayat, G.C.; Chadha, G.K.","Crystal structures of four new polytypes of cadmium iodide","Acta Crystallographica B (24,1968-38,1982)","1970","26","","1785","1791","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "2107280","6.0104","0.0017","6.0104","0.0017","8.162","0.004","90","","90","","120","","255.35","0.16","295","","295","","","","","","","","","3","R 3 m :H","R 3 -2""","160","Potasium bromate","","","- Br K O3 -","- Br1.00002 K1.00002 O3 -","- Br3.00006 K3.00006 O9 -","3","0.166667","EB5041","Santamaría-Pérez, David; Chulia-Jordan, Raquel; Rodríguez-Hernández, Placida; Muñoz, Alfonso","Crystal behavior of potassium bromate under compression","Acta Crystallographica Section B","2015","71","6","798","804","10.1107/S2052520615018156","powder diffraction","","","MoKα","","","","","","","","","11.6302","","","","","","","","has coordinates","170700","2020-10-21","18:00:00","" "2107333","3.079","","3.079","","475.9778","","90","","90","","120","","3907.84","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C189 Si189 -","189","10.5","","Dubey, M.; Ram, U.S.; Singh, G.","A new polytype of silicon carbide, 189R","Acta Crystallographica B (24,1968-38,1982)","1973","29","","1548","1550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2203238","10.6226","0.0019","10.6226","0.0019","4.0954","0.0015","90","","90","","120","","400.21","0.18","273","2","298","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Lanthanum(III) nitrite","","- La N3 O6 -","- La N3 O6 -","- La3 N9 O18 -","3","0.166667","","Qing-Qing Kang; La-Sheng Long; Rong-Bin Huang; Lan-Sun Zheng","La(NO~2~)~3~, a novel (3,9)-connected lanthanide-based network","Acta Crystallographica, Section E","2004","60","2","i12","i14","10.1107/S1600536804000297","","","0.71073","MoKα","","0.0128","0.0128","","","0.0292","0.0292","","","","","","1.137","","","","has coordinates","282068","2023-03-26","10:12:33","" "2204445","14.6795","0.001","14.6795","0.001","7.5114","0.0004","90","","90","","120","","1401.76","0.15","170","2","170","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","Chlorotris(3-methylpyridine-κN)silver(I)","","- C18 H21 Ag Cl N3 -","- C18 H21 Ag Cl N3 -","- C54 H63 Ag3 Cl3 N9 -","3","0.166667","BT6543","Näther, Christian; Beck, Andreas","Chlorotris(3-methylpyridine-κN)silver(I)","Acta Crystallographica Section E","2004","60","11","m1678","m1680","10.1107/S1600536804026121","","","0.71073","MoKα","","0.0295","0.0285","","","0.0676","0.0683","","","","","","1.089","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00","" "2209751","10.503","0.003","10.503","0.003","4.006","0.003","90","","90","","120","","382.7","0.3","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","Samarium(III) formate","poly[samarium(III)-tri-μ-formato]","","- C3 H3 O6 Sm -","- C3 H3 O6 Sm -","- C9 H9 O18 Sm3 -","3","0.166667","BI2026","Yan Xu; Shao-Hua Ding; Guang-Peng Zhou; Yu-Guo Liu","Samarium(III) formate","Acta Crystallographica Section E","2006","62","8","m1749","m1750","10.1107/S1600536806025608","","","0.71073","MoKα","","0.0274","0.0274","","","0.0606","0.0606","","","","","","1.098","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00","" "2212304","38.2597","0.0008","38.2597","","12.3356","0.0006","90","","90","","120","","15637.7","0.8","294","1","294","1","","","","","","","","6","R 3 m :H","R 3 -2""","160","","Bis(μ-3,5-diphenylpyrazolato-κ^2^N:N')bis[(4,4'-dimethyl-2,2'- bipyridine-κ^2^N,N')palladium(II)] bis(hexafluorophosphate)","","- C54 H46 F12 N8 P2 Pd2 -","- C54 H46 F12 N8 P2 Pd2 -","- C486 H414 F108 N72 P18 Pd18 -","9","0.5","NG2188","Hai-Ping Huang; Qiong Wu; Li-Xia Liu; Qing-Fu Song","Bis(μ-3,5-diphenylpyrazolato-κ^2^N:N')-bis[(4,4'-dimethyl-2,2'-bipyridine-κ^2^N,N')palladium(II)] bis(hexafluorophosphate)","Acta Crystallographica Section E","2007","63","2","m458","m459","10.1107/S1600536807000803","","","0.71073","MoKα","","0.0722","0.0694","","","0.1904","0.197","","","","","","1.079","","","","has coordinates,has Fobs","301804","2025-08-19","12:25:35","" "2215465","15.89","0.0004","15.89","0.0004","9.4584","0.0005","90","","90","","120","","2068.22","0.13","193","2","193","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","chlorido[hydridotris(3-tert-butyl-5-methylpyrazolyl)borato]nickel(II)","","- C24 H40 B Cl N6 Ni -","- C24 H40 B Cl N6 Ni -","- C72 H120 B3 Cl3 N18 Ni3 -","3","0.166667","FI2040","Adam D. Beitelman; Gregory M. Ferrence","A redetermination of chlorido[hydridotris(3-tert-butyl-5-methylpyrazolyl)borato]nickel(II)","Acta Crystallographica Section E","2007","63","10","m2520","m2521","10.1107/S1600536807043814","","","0.71073","MoKα","","","0.0175","","","","0.0448","","","","","","1.078","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00","" "2222448","18.687","0.005","18.687","0.005","6.8723","0.0016","90","","90","","120","","2078.3","0.9","295","2","291","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","3-exo-Chloro-8-oxabicyclo[3.2.1]oct-6-ene-2,4-diol chloroform 0.33-solvate","","- C7.33333 H9.33333 Cl2 O3 -","- C7.33333 H9.33333 Cl2 O3 -","- C66 H84 Cl18 O27 -","9","0.5","SI2178","Tafeenko, Viktor A.; Aslanov, Leonid A.; Proskurnina, Marina V.; Sosonyuk, Sergei E.; Khlevin, Dmitrii A.","3-exo-Chloro-8-oxabicyclo[3.2.1]oct-6-ene-2,4-diol chloroform 0.33-solvate","Acta Crystallographica Section E","2009","65","7","o1580","","10.1107/S1600536809021898","","","1.54184","CuKα","","0.0545","0.0538","","","0.1671","0.1681","","","","","","1.175","","","","has coordinates,has Fobs","301805","2025-08-19","13:57:09","" "2300111","3.875218","0.000008","3.875218","","37.20846","0.00011","90","","90","","120","","483.91","0.0017","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- In2 Mn0.4 S4 Zn0.6 -","- In2 Mn0.4 S4 Zn0.6 -","- In6 Mn1.2 S12 Zn1.8 -","3","0.166667","","Ávila-Godoy, Rosario; Mora, Asiloé J.; Acosta-Najarro, Dwight R.; Delgado, Gerzon E.; López-Rivera, Santos A.; Fitch, Andrew N.; Mora, Andrés E.; Steeds, John W.","Structure of the quaternary alloy Zn~0.6~Mn~0.4~In~2~S~4~ from synchrotron powder diffraction and electron transmission microscopy","Journal of Applied Crystallography","2006","39","1","1","5","10.1107/S0021889805032656","","","0.499229","","","","","","","","","","","3.33","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "2300498","5.6085","0.0003","5.6085","0.0003","6.9183","0.0006","90","","90","","120","","188.46","0.02","10","","10","","","","","","","","","4","R 3 m :H","R 3 -2""","160","Sodium Potassium Niobate oxide","Sodium Potassium Niobate oxide","","- K0.5 Na0.5 Nb O3 -","- K0.5 Na0.5 Nb O3 -","- K1.5 Na1.5 Nb3 O9 -","3","0.166667","NB5132","Orayech, B.; Faik, A.; López, G. A.; Fabelo, O.; Igartua, J. M.","Mode-crystallography analysis of the crystal structures and the low- and high-temperature phase transitions in Na~0.5~K~0.5~NbO~3~","Journal of Applied Crystallography","2015","48","2","","","10.1107/S1600576715000941","powder diffraction","","2.52277","ConstantWavelengthNeutronDiffraction","","","","","","","","","7.3147","","","","","","","","has coordinates","176435","2020-10-21","18:00:00","" "2300613","10.1252","0.0014","10.1252","0.0014","8.8687","0.0018","90","","90","","120","","787.4","0.2","296","2","296","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- B6 Br K3 O10 -","- B6 Br K3 O10 -","- B18 Br3 K9 O30 -","3","0.166667","","Xia, Mingjun; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Li, Rukang; Chen, Chuangtian","Thermo-physical properties of nonlinear optical crystal K~3~B~6~O~10~Br","Journal of Applied Crystallography","2016","49","2","539","543","10.1107/S1600576716001126","","","0.71073","MoKα","","0.0194","0.0194","","","0.0449","0.0449","","","","","","1.184","","","","has coordinates,has Fobs","181477","2020-10-21","18:00:00","" "2310533","3.45","","3.45","","18.88","","90","","90","","120","","194.613","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Nb Se2 -","- Nb Se2 -","- Nb3 Se6 -","3","0.166667","","Brown, B.E.; Beerntsen, D.J.","Layer structure polytism among niobium and tantalum selenides","Acta Crystallographica (1,1948-23,1967)","1965","18","","31","36","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "2310588","3.082","","3.082","","60.49","","90","","90","","120","","497.599","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C24 Si24 -","24","1.33333","","Gomes de Mesquita, A.H.","The structure of a silicone carbide polytype 24R","Acta Crystallographica (1,1948-23,1967)","1965","18","","128","128","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310813","3.82","","3.82","","150.24","","90","","90","","120","","1898.64","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Zn S","","- S Zn -","- S Zn -","- S48 Zn48 -","48","2.66667","","Mardix, S.; Alexander, E.; Brafman, O.; Steinberger, I.T.","Polytype families in zinc sulfide crystals","Acta Crystallographica (1,1948-23,1967)","1967","22","","808","812","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310814","3.82","","3.82","","187.8","","90","","90","","120","","2373.3","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Zn S","","- S Zn -","- S Zn -","- S60 Zn60 -","60","3.33333","","Mardix, S.; Alexander, E.; Brafman, O.; Steinberger, I.T.","Polytype families in zinc sulfide crystals","Acta Crystallographica (1,1948-23,1967)","1967","22","","808","812","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310872","7","","7","","25","","90","","90","","120","","1060.88","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ca3 (Si O4) O","","- Ca3 O5 Si -","- Ca3 O5 Si -","- Ca27 O45 Si9 -","9","0.5","","Jeffery, J.W.","The crystal structure of tricalcium silicate","Acta Crystallographica (1,1948-23,1967)","1952","5","","26","35","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310933","3.079","","3.079","","67.99599","","90","","90","","120","","558.256","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C27 Si27 -","27","1.5","","Ramsdell, L.S.; Kohn, J.A.","Developments in silicon carbide research","Acta Crystallographica (1,1948-23,1967)","1952","5","","215","224","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310934","3.079","","3.079","","128.437","","90","","90","","120","","1054.48","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C51 Si51 -","51","2.83333","","Ramsdell, L.S.; Kohn, J.A.","Developments in silicon carbide research","Acta Crystallographica (1,1948-23,1967)","1952","5","","215","244","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310935","3.079","","3.079","","189.259","","90","","90","","120","","1553.84","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C75 Si75 -","75","4.16667","","Ramsdell, L.S.; Kohn, J.A.","Developments in silicon carbide research","Acta Crystallographica (1,1948-23,1967)","1952","5","","215","224","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2310936","3.079","","3.079","","211.543","","90","","90","","120","","1736.8","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C84 Si84 -","84","4.66667","","Ramsdell, L.S.; Kohn, J.A.","Development in silicon carbide research","Acta Crystallographica (1,1948-23,1967)","1952","5","","215","224","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "2311038","3.248","","3.248","","40.03","","90","","90","","120","","365.72","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Al6 C3 N2","","- C3 Al6 N2 -","- C3 Al6 N2 -","- C9 Al18 N6 -","3","0.166667","","Jeffrey, G.A.; Wu, V.Y.","The structures of the aluminum carbonitrides. II","Acta Crystallographica (1,1948-23,1967)","1966","20","","538","547","","","","","","","","","","","","","","","","","","","","","","has coordinates","169370","2020-10-21","18:00:00","" "2311039","3.211","","3.211","","55.08","","90","","90","","120","","491.819","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Al8 C3 N4","","- C3 Al8 N4 -","- C3 Al8 N4 -","- C9 Al24 N12 -","3","0.166667","","Jeffrey, G.A.; Wu, V.Y.","The structures of the aluminum carbonitrides. II","Acta Crystallographica (1,1948-23,1967)","1966","20","","538","547","","","","","","","","","","","","","","","","","","","","","","has coordinates","169371","2020-10-21","18:00:00","" "2311055","3.87","","3.87","","18.95","","90","","90","","120","","245.789","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","(Cu5 Fe S4)1.4","","- Cu6.9984 Fe1.3968 S5.598 -","- Cu6.9984 Fe1.3968 S5.598 -","- Cu6.9984 Fe1.3968 S5.598 -","1","0.0555556","","Morimoto, N.","Structures of two polymorphic forms of Cu5 Fe S4","Acta Crystallographica (1,1948-23,1967)","1964","17","","351","360","","","","","","","","","","","","","","","","","","","","","","has coordinates","172536","2020-10-21","18:00:00","" "2311062","16","","16","","7.17","","90","","90","","120","","1589.61","","","","","","","","","","","","","10","R 3 m :H","R 3 -2""","160","","(Na.875 Ca.125) (Li Al2) (Al5.8 Fe.1 Mn.1) (B O3)3 (Si6 O18) O (O H)3","","- Al7.8 B3 Ca0.125 Fe0.1 H3 Li Mn0.1 Na0.875 O31 Si6 -","- Al7.8102 B3 Ca0.125 Fe0.099 Li0.99 Mn0.099 Na0.875 O31 Si6 -","- Al23.4306 B9 Ca0.375 Fe0.297 Li2.97 Mn0.297 Na2.625 O93 Si18 -","3","0.166667","","Ito, T.; Sadanaga, R.","A Fourier analysis of the structure of tourmaline","Acta Crystallographica (1,1948-23,1967)","1951","4","","385","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "3000228","6.424","0.001","6.424","0.001","8.254","0.001","90","","90","","120","","294.99","0.07","298","2","298","2","","","","","","","synthetic","3","R 3 m :H","R 3 -2""","160","","cesium chlorate(V)","","- Cl Cs O3 -","- Cl Cs O3 -","- Cl3 Cs3 O9 -","3","0.166667","","Reiner, G.; Wartchow, R.","On Potassiumchlorate, K Cl O3, Rubidiumchlorate, Rb Cl O3, and Cesiumchlorate, Cs Cl O3 . IV. Crystal structure of Cs Cl O3 at 298 K","Institutionelles Repositorium der Leibniz Universitaet Hannover","2019","","","","","10.15488/4740","","","0.71073","MoKα","","0.0278","0.0278","","","0.0542","0.0542","","","","","","1.172","","","","has coordinates","301810","2025-08-19","19:21:35","" "4000771","3.7013","0.0013","3.7013","0.0013","36.416","0.0012","90","","90","","120","","432","0.2","150","2","150","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Al2 Mn S4 -","- Al2 Mn S4 -","- Al6 Mn3 S12 -","3","0.166667","","Menard, Melissa C.; Ishii, Rieko; Higo, Tomoya; Nishibori, Eigi; Sawa, Hiroshi; Nakatsuji, Satoru; Chan, Julia Y.","High-Resolution Synchrotron Studies and Magnetic Properties of Frustrated Antiferromagnets MAl2S4(M = Mn2+, Fe2+, Co2+)","Chemistry of Materials","2011","23","12","3086","","10.1021/cm200561p","","","0.7749","synchrotron","","0.023","0.021","","","0.0513","0.0523","","","","","","1.021","","","","has coordinates","178377","2020-10-21","18:00:00","" "4001399","10.673","0.003","10.673","0.003","4.099","0.002","90","","90","","120","","404.4","0.3","273","2","273","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C3 H3 Ce0.9 Gd0.1 O6 -","- C3 H3 Ce0.9 Gd0.1 O6 -","- C9 H9 Ce2.7 Gd0.3 O18 -","3","0.166667","","Go, Yong Bok; Jacobson, Allan J.","Solid Solution Precursors to Gadolinia-Doped Ceria Prepared via a Low-Temperature Solution Route","Chemistry of Materials","2007","19","19","4702","","10.1021/cm071310k","","","0.71073","MoKα","","0.0117","0.0117","","","0.0292","0.0292","","","","","","1.134","","","","has coordinates","176467","2020-10-21","18:00:00","" "4002264","6.799","","6.799","","16.782","","90","","90","","120","","671.838","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ga V4 S8","","- Ga S8 V4 -","- Ga S8 V4 -","- Ga3 S24 V12 -","3","0.166667","","Pocha, R.; Poettgen, R.; Johrendt, D.","Electronic and structural instabilities in Ga V4 S8 and Ga Mo4 S8","Chemistry of Materials (1,1989-)","2000","12","","2882","2887","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "4002674","10.3179","0.0011","10.3179","0.0011","8.3958","0.0013","90","","90","","120","","774.06","0.17","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B5 Be2 F O12 Sr3 -","- B4.68 Be2.32 F1.32 O11.68 Sr3 -","- B14.04 Be6.96 F3.96 O35.04 Sr9 -","3","0.166667","","Yu, Na; Wang, Shichao; Ye, Ning; Liang, Fei; Lin, Zheshuai; Luo, Min; Poeppelmeier, Kenneth R.","A Deep-Ultraviolet Nonlinear Optical Crystal: Strontium Beryllium Borate Fluoride with Planar Be(O/F)3Groups","Chemistry of Materials","2016","28","13","4563","","10.1021/acs.chemmater.6b01111","","x-ray","0.71073","MoKα","","0.0156","0.0156","","","0.037","0.037","","","","","","1.094","","","","has coordinates","184807","2020-10-21","18:00:00","" "4002889","6.6051","0.001","6.6051","0.001","8.087","0.003","90","","90","","120","","305.55","0.13","296","2","296","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Cs I O3 -","- Cs I O3 -","- Cs3 I3 O9 -","3","0.166667","","Zhang, Min; Hu, Cong; Abudouwufu, Tushagu; Yang, Zhihua; Pan, Shilie","Functional Materials Design via Structural Regulation Originated from Ions Introduction: A Study Case in Cesium Iodate System","Chemistry of Materials","2018","30","3","1136","","10.1021/acs.chemmater.7b05252","","","0.71073","MoKα","","0.0287","0.0287","","","0.0657","0.0657","","","","","","1.266","","","","has coordinates","227515","2020-10-21","18:00:00","" "4003973","7.21984","0.00004","7.21984","0.00004","17.44441","0.00012","90","","90","","120","","787.485","0.008","40","","40","","","","","","","","","3","R 3 m :H","R 3 -2""","160","GaMo4Se8","GaMo4Se8","","- Ga Mo4 Se8 -","- Ga Mo4 Se8 -","- Ga3 Mo12 Se24 -","3","0.166667","","Routledge, Kieran; Vir, Praveen; Cook, Nicholas; Murgatroyd, Philip A. E.; Ahmed, Sheikh J.; Savvin, Stanislav N.; Claridge, John B.; Alaria, Jonathan","Mode Crystallography Analysis through the Structural Phase Transition and Magnetic Critical Behavior of the Lacunar Spinel GaMo4Se8","Chemistry of Materials","2021","","","","","10.1021/acs.chemmater.1c01448","powder diffraction","","1.594","Neutron","","","","","","","","","3.1209","2.0291","","","","","","","has coordinates","267297","2021-07-06","22:23:21","" "4003976","7.22163","0.00004","7.22163","0.00004","17.43472","0.00012","90","","90","","120","","787.437","0.008","2","","2","","","","","","","","","3","R 3 m :H","R 3 -2""","160","GaMo4Se8","GaMo4Se8","","- Ga Mo4 Se8 -","- Ga Mo4 Se8 -","- Ga3 Mo12 Se24 -","3","0.166667","","Routledge, Kieran; Vir, Praveen; Cook, Nicholas; Murgatroyd, Philip A. E.; Ahmed, Sheikh J.; Savvin, Stanislav N.; Claridge, John B.; Alaria, Jonathan","Mode Crystallography Analysis through the Structural Phase Transition and Magnetic Critical Behavior of the Lacunar Spinel GaMo4Se8","Chemistry of Materials","2021","","","","","10.1021/acs.chemmater.1c01448","powder diffraction","","1.594","Neutron","","","","","","","","","3.2037","2.1","","","","","","","has coordinates","267298","2021-07-06","22:23:59","" "4003979","7.22081","0.00004","7.22081","0.00004","17.4383","0.00012","90","","90","","120","","787.42","0.008","30","","30","","","","","","","","","3","R 3 m :H","R 3 -2""","160","GaMo4Se8","GaMo4Se8","","- Ga Mo4 Se8 -","- Ga Mo4 Se8 -","- Ga3 Mo12 Se24 -","3","0.166667","","Routledge, Kieran; Vir, Praveen; Cook, Nicholas; Murgatroyd, Philip A. E.; Ahmed, Sheikh J.; Savvin, Stanislav N.; Claridge, John B.; Alaria, Jonathan","Mode Crystallography Analysis through the Structural Phase Transition and Magnetic Critical Behavior of the Lacunar Spinel GaMo4Se8","Chemistry of Materials","2021","","","","","10.1021/acs.chemmater.1c01448","powder diffraction","","1.594","Neutron","","","","","","","","","3.718","2.1839","","","","","","","has coordinates","267299","2021-07-06","22:24:34","" "4003982","7.21861","0.00004","7.21861","0.00004","17.45028","0.00012","90","","90","","120","","787.481","0.008","45","","45","","","","","","","","","3","R 3 m :H","R 3 -2""","160","GaMo4Se8","GaMo4Se8","","- Ga Mo4 Se8 -","- Ga Mo4 Se8 -","- Ga3 Mo12 Se24 -","3","0.166667","","Routledge, Kieran; Vir, Praveen; Cook, Nicholas; Murgatroyd, Philip A. E.; Ahmed, Sheikh J.; Savvin, Stanislav N.; Claridge, John B.; Alaria, Jonathan","Mode Crystallography Analysis through the Structural Phase Transition and Magnetic Critical Behavior of the Lacunar Spinel GaMo4Se8","Chemistry of Materials","2021","","","","","10.1021/acs.chemmater.1c01448","powder diffraction","","1.594","Neutron","","","","","","","","","3.1685","2.0538","","","","","","","has coordinates","267300","2021-07-06","22:25:07","" "4003991","7.22055","0.00004","7.22055","0.00004","17.44069","0.00012","90","","90","","120","","787.472","0.008","35","","35","","","","","","","","","3","R 3 m :H","R 3 -2""","160","GaMo4Se8","GaMo4Se8","","- Ga Mo4 Se8 -","- Ga Mo4 Se8 -","- Ga3 Mo12 Se24 -","3","0.166667","","Routledge, Kieran; Vir, Praveen; Cook, Nicholas; Murgatroyd, Philip A. E.; Ahmed, Sheikh J.; Savvin, Stanislav N.; Claridge, John B.; Alaria, Jonathan","Mode Crystallography Analysis through the Structural Phase Transition and Magnetic Critical Behavior of the Lacunar Spinel GaMo4Se8","Chemistry of Materials","2021","","","","","10.1021/acs.chemmater.1c01448","powder diffraction","","1.594","Neutron","","","","","","","","","3.184","2.1069","","","","","","","has coordinates","267305","2021-07-06","22:27:48","" "4030246","5.6915","0.0005","5.6915","0.0005","27.981","0.001","90","","90","","120","","784.96","0.1","","","293","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ba Fe O2.93 -","- Ba Fe O3 -","- Ba12 Fe12 O36 -","12","0.666667","","Parras, M.; Vallet-Regi, M.; Gonzalet-Calbet, J. M.; Grenier, J. C.; Hagenmullet, P.; Rodriguez-Carvajal, J.","A structural study of 12H-BaFe02.93","European Journal of Solid State and Inorganic Chemistry","1989","26","","299","312","","powder diffraction","x-ray","1.542","CuKα","","","","","","","","","0.0747","","","","","","","","has coordinates","178481","2020-10-21","18:00:00","" "4065646","32.5214","0.0012","32.5214","0.0012","8.7601","0.0007","90","","90","","120","","8023.8","0.8","100","2","100","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","5","","","- C28 H28 Au2 P2 -","- C28 H28 Au2 P2 -","- C252 H252 Au18 P18 -","9","0.5","","Nguyen, Minh-Hai; Yip, John H. K.","Gold(I) and Platinum(II) Tetracenes and Tetracenyldiacetylides: Structural and Fluorescence Color Changes Induced by σ-Metalation","Organometallics","2010","29","11","2422","","10.1021/om100046h","","","0.71073","MoKα","","0.056","0.0515","","","0.1295","0.1325","","","","","","1.084","","","","has coordinates,has disorder","178549","2020-10-21","18:00:00","" "4067930","17.866","0.003","17.866","0.003","9.887","0.003","90","","90","","120","","2733.1","1.1","153","2","153","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C34 H35 Cl2 N3 O6 S3 -","- C33.99 H34.98 Cl2 N3 O6 S3 -","- C101.97 H104.94 Cl6 N9 O18 S9 -","3","0.166667","","Brun, Sandra; Torrent, Anna; Pla-Quintana, Anna; Roglans, Anna; Fontrodona, Xavier; Benet-Buchholz, Jordi; Parella, Teodor","Rhodium(I)-Catalyzed [2 + 2 + 2] Cycloaddition Reactions of Triacetylenic 15-Membered Aza Macrocycles: A Comparative Structural Study","Organometallics","2012","31","1","318","","10.1021/om200927f","","","0.71073","MoKα","","0.1394","0.0655","","","0.1386","0.1598","","","","","","0.886","","","","has coordinates","178570","2020-10-21","18:00:00","" "4102270","15.9843","0.0017","15.9843","0.0017","9.4269","0.001","90","","90","","120","","2085.9","0.4","190","2","190","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C24 H40 B Cl Co N6 -","- C24 H40 B Cl Co N6 -","- C72 H120 B3 Cl3 Co3 N18 -","3","0.166667","","J. Krzystek; Dale C. Swenson; S. A. Zvyagin; Dmitry Smirnov; Andrew Ozarowski; Joshua Telser","Cobalt(II) ""Scorpionate"" Complexes as Models for Cobalt-Substituted Zinc Enzymes: Electronic Structure Investigation by High-Frequency and -Field Electron Paramagnetic Resonance Spectroscopy","Journal of the American Chemical Society","2010","132","","5241","5253","10.1021/ja910766w","","","0.71073","MoKα","","0.0246","0.0231","","","0.0552","0.056","","","","","","1.087","","","","has coordinates","176432","2020-10-21","18:00:00","" "4103186","26.3043","0.0011","26.3043","0.0011","26.5885","0.0019","90","","90","","120","","15932.3","1.5","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","UMCM-152","","","- C14 H7 Cu O5 -","- C14 H7 Cu O5 -","- C252 H126 Cu18 O90 -","18","1","","Jennifer K. Schnobrich; Olivier Lebel; Katie A. Cychosz; Anne Dailly; Antek G. Wong-Foy; Adam J. Matzger","Linker-Directed Vertex Desymmetrization for the Production of Coordination Polymers with High Porosity","Journal of the American Chemical Society","2010","132","","13941","13948","10.1021/ja107423k","","","1.54187","CuKα","","0.0681","0.0555","","","0.1404","0.1555","","","","","","1.053","","","","has coordinates","178777","2020-10-21","18:00:00","" "4103911","9.0792","0.0005","9.0792","0.0005","5.8922","0.0005","90","","90","","120","","420.63","0.05","150","","150","","","","","","","","Christina Tang, Oxford.","4","R 3 m :H","R 3 -2""","160","","","","- C3 H12 B N -","- C3 H12 B N -","- C9 H36 B3 N3 -","3","0.166667","","Simon Aldridge; Anthony J. Downs; Christina Y. Tang; Simon Parsons; Michael C. Clarke; Russell D. L. Johnstone; Heather E. Robertson; David W. H. Rankin; Derek A. Wann","Structures and Aggregation of the Methylamine-Borane Molecules, MenH3-nN.BH3 (n= 1-3), Studied by X-ray Diffraction, Gas-Phase Electron Diffraction, and Quantum Chemical Calculations","Journal of the American Chemical Society","2009","131","","2231","2243","10.1021/ja807545p","","","0.71073","MoKα","","0.0286","0.0283","","0.0738","0.0734","0.0738","","","","","","1.0092","","","","has coordinates","301832","2025-08-20","14:35:18","" "4106144","10.0624","0.0014","10.0624","0.0014","8.8361","0.0018","90","","90","","120","","774.8","0.2","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- B6 Cl K3 O10 -","- B6 Cl K3 O10 -","- B18 Cl3 K9 O30 -","3","0.166667","","Hongping Wu; Shilie Pan; Kenneth R. Poeppelmeier; Hongyi Li; Dianzeng Jia; Zhaohui Chen; Xiaoyun Fan; Yun Yang; James M. Rondinelli; Haosu Luo","K3B6O10Cl: A New Structure Analogous to Perovskite with a Large Second Harmonic Generation Response and Deep UV Absorption Edge","Journal of the American Chemical Society","2011","133","","7786","7790","10.1021/ja111083x","","","0.71073","MoKα","","0.0143","0.0138","","","0.032","0.0323","","","","","","1.188","","","","has coordinates","178807","2020-10-21","18:00:00","" "4112542","48.2928","0.0011","48.2928","0.0011","11.8656","0.0011","90","","90","","120","","23965","2","298","2","298","2","","","","","","","chemical synthesis","3","R 3 m :H","R 3 -2""","160","","Hexakis(2',3',4',5',6'-pentaphenylbiphenyl-4-yl)benzene","","- C272 H202 Cl28 -","- C264 H174 -","- C792 H522 -","3","0.166667","","Xianfeng Shen; Douglas M. Ho; Robert A. Pascal","Synthesis of Polyphenylene Dendrimers Related to ""Cubic Graphite""","Journal of the American Chemical Society","2004","126","","5798","5805","10.1021/ja030675c","","","0.71073","MoKα","","0.1545","0.1321","","0.3751","0.3431","","","","1.033","1.204","1.204","","","","","has coordinates,has disorder","178896","2020-10-21","18:00:00","" "4114916","13.5674","0.0019","13.5674","0.0019","21.855","0.004","90","","90","","120","","3484","0.9","293","2","293","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- Cs H6 Na O14 Si4 V -","- Cs1.00233 Na O12.5867 Si4 V -","- Cs9.021 Na9 O113.28 Si36 V9 -","9","0.5","","Xiqu Wang; Lumei Liu; Allan J. Jacobson","Open-Framework and Microporous Vanadium Silicates","Journal of the American Chemical Society","2002","124","","7812","7820","10.1021/ja020354l","","","0.71073","MoKα","","0.084","0.0754","","","0.2225","0.2283","","","","","","1.174","","","","has coordinates","176467","2020-10-21","18:00:00","" "4115480","18.704","0.003","18.704","0.003","3.7792","0.0007","90","","90","","120","","1145","0.3","299","1","299","1","","","","","","","Synthesized in the laboratory of R. C. Haddon.","2","R 3 m :H","R 3 -2""","160","Perchlorophenalenyl","Perchlorophenalenyl","","- C13 Cl9 -","- C13 Cl9 -","- C39 Cl27 -","3","0.166667","","P. A. Koutentis; Y. Chen; Y. Cao; T. P. Best; M. E. Itkis; L. Beer; R. T. Oakley; A. W. Cordes; C. P. Brock; R. C. Haddon","Perchlorophenalenyl Radical","Journal of the American Chemical Society","2001","123","","3864","3871","10.1021/ja0018015","","","0.71073","MoKα","","0.041","0.04","","","0.1","0.1","","","","","","1.07","","","","has coordinates","178925","2020-10-21","18:00:00","" "4122440","25.8595","0.001","25.8595","","6.7766","0.0004","90","","90","","120","","3924.5","0.3","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C4 H2.05 Co O3 -","- C4 H2.046 Co O3 -","- C72 H36.828 Co18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.0775","","","","","","","","","0.03547","","0.99","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4122441","25.8419","0.0017","25.8419","","6.781","0.0007","90","","90","","120","","3921.7","0.5","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D1.69 O3 -","- C4 H Co D1.69 O3 -","- C72 H18 Co18 D30.42 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.05711","","0.91","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122442","25.8734","0.0023","25.8734","","6.7677","0.0009","90","","90","","120","","3923.5","0.6","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C4 H Co O3 -","- C4 H Co O3 -","- C72 H18 Co18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.06401","","0.93","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4122444","25.776","0.005","25.776","","6.7544","0.0017","90","","90","","120","","3886.4","1.2","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H D3.85 Ni O3 -","- C4 H D3.855 Ni O3 -","- C72 H18 D69.39 Ni18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.14026","","1.29","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4122445","25.8923","0.0017","25.8923","","6.8115","0.0006","90","","90","","120","","3954.7","0.4","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D5.63 O3 -","- C4 H Co D5.62762 O3 -","- C72 H18 Co18 D101.297 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.05497","","0.93","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122446","25.8826","0.001","25.8826","","6.803","0.0004","90","","90","","120","","3946.8","0.3","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D3.47 O3 -","- C4 H Co D3.474 O3 -","- C72 H18 Co18 D62.532 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.05113","","1.16","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122447","25.749","0.004","25.749","","6.739","0.0012","90","","90","","120","","3869.4","0.9","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H D1.97 Ni O3 -","- C4 H D1.97 Ni O3 -","- C72 H18 D35.46 Ni18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.06133","","0.99","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4122448","25.8806","0.0017","25.8806","","6.8038","0.0006","90","","90","","120","","3946.7","0.4","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D3.73 O3 -","- C4 H Co D3.94262 O3 -","- C72 H18 Co18 D70.9672 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.06241","","0.93","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122449","25.8902","0.0007","25.8902","","6.79046","0.00029","90","","90","","120","","3941.9","0.2","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C4 H Co O3 -","- C4 H1.5 Co O3 -","- C72 H27 Co18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","x-ray","0.7291","","","","","","","","","0.1551","","2.12","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4122450","25.8518","0.0012","25.8518","","6.7881","0.0005","90","","90","","120","","3928.8","0.3","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D2.37 O3 -","- C4 H Co D2.37 O3 -","- C72 H18 Co18 D42.66 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.04809","","1.06","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122451","25.802","0.005","25.802","","6.7613","0.0017","90","","90","","120","","3898.2","1.2","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H D5.77 Ni O3 -","- C4 H2 D5.77 Ni O3 -","- C72 H36 D103.86 Ni18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.13436","","1.24","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4122453","25.8521","0.0018","25.8521","","6.7898","0.0007","90","","90","","120","","3929.9","0.5","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D2.71 O3 -","- C4 H Co D2.71 O3 -","- C72 H18 Co18 D48.78 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.0811","","0.94","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122454","25.9008","0.0011","25.9008","","6.8104","0.0004","90","","90","","120","","3956.7","0.3","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C4 H Co D4.49 O3 -","- C4 H Co D5.012 O3 -","- C72 H18 Co18 D90.216 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.05108","","1.07","","","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4122455","25.797","0.005","25.797","","6.7292","0.0017","90","","90","","120","","3878.2","1.2","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C4 H Ni O3 -","- C4 H Ni O3 -","- C72 H18 Ni18 O54 -","18","1","","Kapelewski, Matthew T.; Geier, Stephen J.; Hudson, Matthew R.; Stück, David; Mason, Jarad A.; Nelson, Jocienne N.; Xiao, Dianne J.; Hulvey, Zeric; Gilmour, Elizabeth; FitzGerald, Stephen A.; Head-Gordon, Martin; Brown, Craig M.; Long, Jeffrey R.","M2(m-dobdc) (M = Mg, Mn, Fe, Co, Ni) Metal-Organic Frameworks Exhibiting Increased Charge Density and Enhanced H2 Binding at the Open Metal Sites.","Journal of the American Chemical Society","2014","136","34","12119","","10.1021/ja506230r","powder diffraction","neutron","2.078","","","","","","","","","0.08281","","1.09","","","","","","","has coordinates","179026","2020-10-21","18:00:00","" "4123586","9.4937","0.0001","9.4937","0.0001","6.9591","0.0002","90","","90","","120","","543.194","0.018","100","2","100","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","PTA","1,3,5-triaza-7-phosphaadamantane","","- C6 H12 N3 P -","- C6 H12 N3 P -","- C18 H36 N9 P3 -","3","0.166667","","Britvin, Sergey N.; Lotnyk, Andriy","Water-Soluble Phosphine Capable of Dissolving Elemental Gold: The Missing Link between 1,3,5-Triaza-7-phosphaadamantane (PTA) and Verkade's Ephemeral Ligand.","Journal of the American Chemical Society","2015","137","16","5526","5535","10.1021/jacs.5b01851","","","0.71073","MoKα","","0.0165","0.0163","","","0.0493","0.0494","","","","","","1.199","","","","has coordinates","301834","2025-08-20","16:40:48","" "4123710","8.3582","0.0011","8.3582","0.0011","10.6098","0.0015","90","","90","","120","","641.89","0.15","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Cesium_Germanium_Iodide","","","- Cs Ge I3 -","- Cs Ge I3 -","- Cs3 Ge3 I9 -","3","0.166667","","Stoumpos, Constantinos C.; Frazer, Laszlo; Clark, Daniel J.; Kim, Yong Soo; Rhim, Sonny H.; Freeman, Arthur J.; Ketterson, John B.; Jang, Joon I.; Kanatzidis, Mercouri G.","Hybrid germanium iodide perovskite semiconductors: active lone pairs, structural distortions, direct and indirect energy gaps, and strong nonlinear optical properties.","Journal of the American Chemical Society","2015","137","21","6804","6819","10.1021/jacs.5b01025","","","0.71073","MoKα","","0.0278","0.0273","","","0.0586","0.0587","","","","","","1.232","","","","has coordinates","176428","2020-10-21","18:00:00","" "4123711","8.5534","0.0013","8.5534","0.0013","11.162","0.002","90","","90","","120","","707.2","0.2","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","Methylammonium_Germanium_Iodide","","","- C H6 Ge I3 N -","- C Ge I3 N -","- C3 Ge3 I9 N3 -","3","0.166667","","Stoumpos, Constantinos C.; Frazer, Laszlo; Clark, Daniel J.; Kim, Yong Soo; Rhim, Sonny H.; Freeman, Arthur J.; Ketterson, John B.; Jang, Joon I.; Kanatzidis, Mercouri G.","Hybrid germanium iodide perovskite semiconductors: active lone pairs, structural distortions, direct and indirect energy gaps, and strong nonlinear optical properties.","Journal of the American Chemical Society","2015","137","21","6804","6819","10.1021/jacs.5b01025","","","0.71073","MoKα","","0.0382","0.0366","","","0.0533","0.0536","","","","","","1.366","","","","has coordinates","176428","2020-10-21","18:00:00","" "4123712","8.4669","0.0015","8.4669","0.0015","11.729","0.002","90","","90","","120","","728.2","0.2","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","Formamidinium_Germanium_Iodide","","","- C H5 Ge I3 N2 -","- C Ge I3 N1.99 -","- C3 Ge3 I9 N5.97 -","3","0.166667","","Stoumpos, Constantinos C.; Frazer, Laszlo; Clark, Daniel J.; Kim, Yong Soo; Rhim, Sonny H.; Freeman, Arthur J.; Ketterson, John B.; Jang, Joon I.; Kanatzidis, Mercouri G.","Hybrid germanium iodide perovskite semiconductors: active lone pairs, structural distortions, direct and indirect energy gaps, and strong nonlinear optical properties.","Journal of the American Chemical Society","2015","137","21","6804","6819","10.1021/jacs.5b01025","","","0.71073","MoKα","","0.0332","0.027","","","0.0485","0.051","","","","","","1.112","","","","has coordinates","176428","2020-10-21","18:00:00","" "4124624","3.171","","3.171","","18.34499","","90","","90","","120","","159.75","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Mo S2 -","- Mo S2 -","- Mo3 S6 -","3","0.166667","","Bell, R.E.; Herfert, R.E.","Preparation and characterization of a new crystalline form of molybdenum bisulfide","Journal of the American Chemical Society","1957","79","","3351","3354","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "4126155","34.7647","0.0011","34.7647","0.0011","10.8425","0.0004","90","","90","","120","","11348.5","0.7","100","2","99.95","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C28 H64 Mn4 N8 -","- C28 H63.625 Mn4 N8 -","- C336 H763.5 Mn48 N96 -","12","0.666667","","Vaddypally, Shivaiah; Kondaveeti, Sandeep K.; Karki, Santosh; Van Vliet, Megan M.; Levis, Robert J.; Zdilla, Michael J.","Reactive Pendant Mn═O in a Synthetic Structural Model of a Proposed S4 State in the Photosynthetic Oxygen Evolving Complex.","Journal of the American Chemical Society","2017","139","13","4675","4681","10.1021/jacs.6b05906","","","0.71073","MoKα","","0.023","0.0215","","","0.0543","0.0551","","","","","","1.042","","","","has coordinates,has disorder","208816","2020-10-21","18:00:00","" "4126609","25.751","0.004","25.751","0.004","6.8192","0.0011","90","","90","","120","","3916.1","1.1","100","2","100","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C12 H10 Co2 O6 -","- C12 H2 Co2 O6 -","- C108 H18 Co18 O54 -","9","0.5","","Bachman, Jonathan E.; Kapelewski, Matthew T.; Reed, Douglas A.; Gonzalez, Miguel I.; Long, Jeffrey R.","M2(m-dobdc) (M = Mn, Fe, Co, Ni) Metal-Organic Frameworks as Highly-Selective, High-Capacity Adsorbents for Olefin/Paraffin Separations.","Journal of the American Chemical Society","2017","","","","","10.1021/jacs.7b06397","","","0.8856","synchrotron","","0.0537","0.0456","","","0.1099","0.1151","","","","","","1.078","","","","has coordinates","208816","2020-10-21","18:00:00","" "4127188","25.8977","0.0009","25.8977","0.0009","6.7599","0.0003","90","","90","","120","","3926.4","0.3","100","2","100","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","Co2(m-dobdc)(EB)0.63(H2O)0.61","","","- C14.15 H10.91 Co2 O6.61 -","- C13.0208 H8.276 Co2 O6.5954 -","- C117.187 H74.484 Co18 O59.3586 -","9","0.5","","Gonzalez, Miguel I.; Kapelewski, Matthew T.; Bloch, Eric D.; Milner, Phillip J.; Reed, Douglas A.; Hudson, Matthew R.; Mason, Jarad A.; Barin, Gokhan; Brown, Craig M.; Long, Jeffrey R.","Separation of Xylene Isomers through Multiple Metal Site Interactions in Metal-Organic Frameworks.","Journal of the American Chemical Society","2018","","","","","10.1021/jacs.7b13825","","","0.8856","synchrotron","","0.044","0.0399","","","0.108","0.1099","","","","","","1.083","","","","has coordinates,has disorder","208816","2020-10-21","18:00:00","" "4133727","25.982","0.001","25.982","0.001","6.8437","0.0005","90","","90","","120","","4001","0.4","250","","250","","","","","","","","","4","R 3 m :H","R 3 -2""","160","Co2mdobdc_1C4H8","","","- C7.28 H7.56 Co O3 -","- C7.78 H7.56 Co O3 -","- C140.04 H136.08 Co18 O54 -","18","1","","Barnett, Brandon R.; Parker, Surya T.; Paley, Maria V.; Gonzalez, Miguel I.; Biggins, Naomi; Oktawiec, Julia; Long, Jeffrey R.","Thermodynamic Separation of 1-Butene from 2-Butene in Metal-Organic Frameworks with Open Metal Sites.","Journal of the American Chemical Society","2019","141","45","18325","18333","10.1021/jacs.9b09942","powder diffraction","x-ray","0.45415","synchrotron","","","","","","","","","0.032","4.053","","","","","","","has coordinates","243433","2020-10-21","18:00:00","" "4133728","26.089","0.003","26.089","0.003","6.8483","0.0008","90","","90","","120","","4036.7","0.8","125","","125","","","","","","","","","4","R 3 m :H","R 3 -2""","160","Co2mdobdc_cisC4H8_1p5","","","- C8.17 H8.28 Co O3 -","- C9.17 H8.78 Co O3 -","- C165.06 H158.04 Co18 O54 -","18","1","","Barnett, Brandon R.; Parker, Surya T.; Paley, Maria V.; Gonzalez, Miguel I.; Biggins, Naomi; Oktawiec, Julia; Long, Jeffrey R.","Thermodynamic Separation of 1-Butene from 2-Butene in Metal-Organic Frameworks with Open Metal Sites.","Journal of the American Chemical Society","2019","141","45","18325","18333","10.1021/jacs.9b09942","powder diffraction","x-ray","0.45411","synchrotron","","","","","","","","","0.031","2.85","","","","","","","has coordinates","243433","2020-10-21","18:00:00","" "4305348","16.8644","0.001","16.8644","0.001","8.1583","0.001","90","","90","","120","","2009.4","0.3","153","2","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C24 H31 B N9 Tl -","- C24 H31 B N9 Tl -","- C72 H93 B3 N27 Tl3 -","3","0.166667","","Ningfeng Zhao; John C. Bullinger; Michael J. Van Stipdonk; Charlotte L. Stern; David M. Eichhorn","Cyanoscorpionates: Synthesis and Crystallographic Characterization of One-Dimensional Cu(I) Coordination Polymers","Inorganic Chemistry","2008","47","","5945","5950","10.1021/ic8003307","","x-ray","0.71073","MoKα","","","0.0246","","","","0.0499","","","","","","1.064","","","","has coordinates","301836","2025-08-20","19:34:57","" "4305386","11.1729","0.0019","11.1729","0.0019","14.705","0.003","90","","90","","120","","1589.7","0.5","100","2","100","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","tricarbonyltris(tetrahydrothiophene)rhenium(I) hexafluorophosphate","","- C15 H24 F6 O3 P Re S3 -","- C15 F6 O3 P Re S3 -","- C45 F18 O9 P3 Re3 S9 -","3","0.166667","","Brenton R. Franklin; Richard S. Herrick; Christopher J. Ziegler; Natalie Barone; Laura R. Condon","Reactions of the Re(CO)3(H2O)3+ Synthon with Monodentate Ligands under Aqueous Conditions","Inorganic Chemistry","2008","47","","5902","5909","10.1021/ic800363w","","","0.71073","MoKα","","0.0169","0.0169","","","0.0397","0.0397","","","","","","1","","","","has coordinates,has disorder","179091","2020-10-21","18:00:00","" "4306275","29.7444","0.0007","29.7444","0.0007","13.6254","0.0009","90","","90","","120","","10439.8","0.8","173","2","173","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","","- H56 K11 O146 P4 Rb7 Ti9 W27 -","- K9 O137.5 P4 Rb4 Ti9 W27 -","- K27 O412.5 P12 Rb12 Ti27 W81 -","3","0.166667","","Ghada A. Al-Kadamany; Firasat Hussain; Sib Sankar Mal; Michael H. Dickman; Nathalie Leclerc-Laronze; Jérôme Marrot; Emmanuel Cadot; Ulrich Kortz","Cyclic Ti9 Keggin Trimers with Tetrahedral (PO4) or Octahedral (TiO6) Capping Groups","Inorganic Chemistry","2008","47","","8574","8576","10.1021/ic801114n","","","0.71073","MoKα","","0.0792","0.0639","","","0.1705","0.1853","","","","","","1.064","","","","has coordinates","179100","2020-10-21","18:00:00","" "4306276","30.3253","0.0011","30.3253","0.0011","15.8808","0.0014","90","","90","","120","","12647.7","1.3","293","2","293","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","","- Cs11.5 K1.5 Na1.5 O134 Si3 Ti10 W27 -","- Cs11.5 K1.5 Na1.56 O134.76 Si3 Ti10 W27 -","- Cs34.5 K4.5 Na4.68 O404.28 Si9 Ti30 W81 -","3","0.166667","","Ghada A. Al-Kadamany; Firasat Hussain; Sib Sankar Mal; Michael H. Dickman; Nathalie Leclerc-Laronze; Jérôme Marrot; Emmanuel Cadot; Ulrich Kortz","Cyclic Ti9 Keggin Trimers with Tetrahedral (PO4) or Octahedral (TiO6) Capping Groups","Inorganic Chemistry","2008","47","","8574","8576","10.1021/ic801114n","","","0.71073","MoKα","","0.0389","0.0258","","","0.072","0.0937","","","","","","1.233","","","","has coordinates","176467","2020-10-21","18:00:00","" "4308704","22.937","0.005","22.937","0.005","12.123","0.005","90","","90","","120","","5523","3","203","2","203","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","(21) [Dy(OSiPh3)3(py)3]","","","- C69 H60 Dy N3 O3 Si3 -","- C69 Dy N3 O3 Si3 -","- C207 Dy3 N9 O9 Si9 -","3","0.166667","","Timothy J. Boyle; Scott D. Bunge; Paul G. Clem; Jacob Richardson; Jeffrey T. Dawley; Leigh Anna M. Ottley; Mark A. Rodriguez; Bruce A. Tuttle; Gabriel R. Avilucea; Ralph G. Tissot","Synthesis and Characterization of a Family of Structurally Characterized Dysprosium Alkoxides for Improved Fatigue-Resistance Characteristics of PDyZT Thin Films","Inorganic Chemistry","2005","44","","1588","1600","10.1021/ic048550b","","","0.71073","MoKα","","0.0644","0.064","","","0.1619","0.1623","","","","","","1.149","","","","has coordinates","179125","2020-10-21","18:00:00","" "4309242","17.2672","0.0006","17.2672","0.0006","27.4602","0.0019","90","","90","","120","","7090.5","0.6","193","2","193","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C33 H96 O44 Zr13 -","- C36 O44 Zr13 -","- C108 O132 Zr39 -","3","0.166667","","Victor W. Day; Walter G. Klemperer; Margaret Mary Pafford","Methyltriskaidecazirconates, Molecular Forms of Zirconia","Inorganic Chemistry","2005","44","","5397","5404","10.1021/ic048307c","","","0.71073","MoKα","","0.1413","0.0506","","","0.1163","0.1387","","","","","","0.869","","","","has coordinates","179130","2020-10-21","18:00:00","" "4310717","11.5386","0.001","11.5386","0.001","28.264","0.003","90","","90","","120","","3258.9","0.5","110","2","110","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","","- C12 Cl3 Cs7 Mo4 N12 Na4 Se4 -","- C12 Cl3.013 Cs7 Mo4 N12 Na4 Se4 -","- C36 Cl9.039 Cs21 Mo12 N36 Na12 Se12 -","3","0.166667","","Carmela Magliocchi; Xiaobing Xie; Timothy Hughbanks","Cyanide-Melt Synthesis of Reduced Molybdenum Selenide Clusters","Inorganic Chemistry","2004","43","","1902","1911","10.1021/ic035050u","","","0.71073","MoKα","","0.069","0.0448","","","0.0962","0.1043","","","","","","1.139","","","","has coordinates,has disorder","179146","2020-10-21","18:00:00","" "4312088","27.7","0.003","27.7","0.003","9.143","0.002","90","","90","","120","","6075.5","1.6","293","2","293","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C23 H29 Cl3 Mo N4 O3 -","- C23 H34 Cl3 Mo N4 O3 -","- C207 H306 Cl27 Mo9 N36 O27 -","9","0.5","","Brian S. Hammes; Bal S. Chohan; Justin T. Hoffman; Simon Einwächter; Carl J. Carrano","A Family of Dioxo-Molybdenum(VI) Complexes of N2X Heteroscorpionate Ligands of Relevance to Molybdoenzymes","Inorganic Chemistry","2004","43","","7800","7806","10.1021/ic049130p","","","0.71073","MoKα","","0.061","0.0503","","0.1377","0.1266","","","","0.988","0.99","0.99","","","","","has coordinates","179159","2020-10-21","18:00:00","" "4312579","16.205","0.003","16.205","0.003","9.355","0.002","90","","90","","120","","2127.5","0.7","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C24 H54 N6 V -","- C24.003 H51 N6 V -","- C72.009 H153 N18 V3 -","3","0.166667","","Booyong S. Lim; Antti Rahtu; Jin-Seong Park; Roy G. Gordon","Synthesis and Characterization of Volatile, Thermally Stable, Reactive Transition Metal Amidinates","Inorganic Chemistry","2003","42","","7951","7958","10.1021/ic0345424","","","0.71073","MoKα","","0.0438","0.0427","","","0.1135","0.1146","","","","","","1.054","","","","has coordinates,has disorder","179164","2020-10-21","18:00:00","" "4319886","19.4527","0.0002","19.4527","0.0002","6.172","0.0001","90","","90","","120","","2022.63","0.04","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- Na6 P4 Pb3 S16 -","- Na6 P4 Pb3 S16 -","- Na18 P12 Pb9 S48 -","3","0.166667","","Jennifer A. Aitken; Mercouri G. Kanatzidis","α-Na6Pb3(PS4)4, a Noncentrosymmetric Thiophosphate with the Novel, Saucer-Shaped [Pb3(PS4)4]6- Cluster, and Its Metastable, 3-Dimensionally Polymerized Allotrope β-Na6Pb3(PS4)4","Inorganic Chemistry","2001","40","","2938","2939","10.1021/ic015511g","","","0.71073","MoKα","","0.0201","0.0196","","","0.0496","0.0497","","","","","","1.175","","","","has coordinates","288183","2023-12-08","14:42:59","" "4322862","12.223","0.002","12.223","0.002","21.461","0.006","90","","90","","120","","2776.7","1","113","2","113","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","barium heptaammine fulleride ammonia (1/1)","","- C60 H24 Ba N8 -","- C60 H24 Ba N8 -","- C180 H72 Ba3 N24 -","3","0.166667","","Klaus Himmel; Martin Jansen","Synthesis and Single-Crystal Structure Analysis of [Ba(NH3)7]C60.NH3","Inorganic Chemistry","1998","37","","3437","3439","10.1021/ic9715512","","","0.71069","MoKα","","0.0233","0.0226","","0.0558","0.0553","","","","1.068","1.064","1.064","","","","","has coordinates","179331","2020-10-21","18:00:00","" "4323083","7.361","0.001","7.361","0.001","10.401","0.001","90","","90","","120","","488.07","0.1","293","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- Cl Cu3 S3 Te -","- Cl Cu3 S3 Te -","- Cl3 Cu9 S9 Te3 -","3","0.166667","","A. Pfitzner","CuClCu~2~TeS~3~: Synthesis, Structure Determination, and Raman Spectroscopic Characterization of a New Zincblende Derivative","Inorganic Chemistry","1998","37","","5164","5167","10.1021/ic9804521","","x-ray","0.71073","MoKα","","0.0164","0.0164","","0.0435","0.0435","","","","1.14","1.14","1.14","","","","","has coordinates","176467","2020-10-21","18:00:00","" "4323187","11.36","0.0007","11.36","0.0007","50.392","0.008","90","","90","","120","","5631.8","1","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Mo9 O18 Pr4 -","- Mo8.998 O18 Pr4 -","- Mo134.97 O270 Pr60 -","15","0.833333","","J. Tortelier; P. Gougeon","Pr~4~Mo~9~O~18~, an Atypical, Novel, Ternary Reduced Molybdenum Oxide Containing Unusual Mo~7~, Mo~13~ and Mo~19~ Clusters. Synthesis, Crystal Structure, and Physical Properties","Inorganic Chemistry","1998","37","","6229","6236","10.1021/ic980500h","","","0.7107","MoKα","","0.0282","0.0242","","0.0485","0.0469","","","","1.096","1.103","1.103","","","","","has coordinates","179334","2020-10-21","18:00:00","" "4325385","55.286","0.005","55.286","0.005","20.523","0.002","90","","90","","120","","54325","9","125","2","125","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","U30a","","","- Ba15 O675 Rb29 U90 -","- Ba15 O675 Rb28.98 U90 -","- Ba45 O2025 Rb86.94 U270 -","3","0.166667","","Daniel K. Unruh; Jie Ling; Jie Qiu; Laura Pressprich; Melissa Baranay; Matthew Ward; Peter C. Burns","Complex nanoscale Cage Clusters Built from Uranyl Polyhedra and Phosphate Tetrahedra","Inorganic Chemistry","2011","50","","5509","5516","10.1021/ic200065y","","","0.71073","MoKα","","0.0479","0.0365","","","0.0919","0.0945","","","","","","1.01","","","","has coordinates","179356","2020-10-21","18:00:00","" "4325703","10.2843","0.0015","10.2843","0.0015","8.477","0.0017","90","","90","","120","","776.5","0.2","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B5 Be2 H O13 Sr3 -","- B4.99 Be2.01 H O13 Sr3 -","- B14.97 Be6.03 H3 O39 Sr9 -","3","0.166667","","Colin D. McMillen; Joseph W. Kolis","Hydrothermal Synthesis and Crystal Structures of Two Novel Acentric Mixed Alkaline Earth Metal Berylloborates Sr3Be2B5O12(OH) and Ba3Be2B5O12(OH)","Inorganic Chemistry","2011","50","","6809","6813","10.1021/ic2008705","","","0.71073","MoKα","","0.025","0.0249","","","0.0613","0.0614","","","","","","1.131","","","","has coordinates","179360","2020-10-21","18:00:00","" "4325704","10.5615","0.0015","10.5615","0.0015","8.8574","0.0018","90","","90","","120","","855.6","0.2","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B5 Ba3 Be2 H O13 -","- B4.99 Ba3 Be2.01 H O13 -","- B14.97 Ba9 Be6.03 H3 O39 -","3","0.166667","","Colin D. McMillen; Joseph W. Kolis","Hydrothermal Synthesis and Crystal Structures of Two Novel Acentric Mixed Alkaline Earth Metal Berylloborates Sr3Be2B5O12(OH) and Ba3Be2B5O12(OH)","Inorganic Chemistry","2011","50","","6809","6813","10.1021/ic2008705","","","0.71073","MoKα","","0.0159","0.0159","","","0.0387","0.0387","","","","","","1.17","","","","has coordinates","179360","2020-10-21","18:00:00","" "4326177","34.6504","0.0009","34.6504","0.0009","23.2241","0.0012","90","","90","","120","","24148.3","1.5","291","2","291","2","","","","","","","","8","R 3 m :H","R 3 -2""","160","","","","- C189 H309 B9 Cl9 Cr9 Cu9 N108 O51 -","- C189 H309 B9 Cl9 Cr9 Cu9 N108 O51 -","- C567 H927 B27 Cl27 Cr27 Cu27 N324 O153 -","3","0.166667","","Min-Xia Yao; Zheng-You Wei; Zhi-Guo Gu; Qi Zheng; Yan Xu; Jing-Lin Zuo","Syntheses, Structures, and Magnetic Properties of Low-Dimensional Heterometallic Complexes Based on the Versatile Building Block [(Tp)Cr(CN)3]-","Inorganic Chemistry","2011","50","","8636","8644","10.1021/ic2011875","","","0.71073","MoKα","","0.0589","0.0475","","","0.0989","0.101","","","","","","1.003","","","","has coordinates","179364","2020-10-21","18:00:00","" "4333657","13.1029","0.0006","13.1029","0.0006","8.041","0.0004","90","","90","","120","","1195.57","0.1","293","2","293","2","","","","","","","","2","R 3 m :H","R 3 -2""","160","Au4.27Zn8.26","","","- Au4.27 Zn8.26 -","- Au4.2595 Zn8.268 -","- Au25.557 Zn49.608 -","6","0.333333","","Srinivasa Thimmaiah; Gordon J. Miller","rhombohedrally Distorted γ-Au5-xZn8+y Phases in the Au-Zn System","Inorganic Chemistry","2013","52","","1328","1337","10.1021/ic301933a","","","0.71073","MoKα","","0.0691","0.0513","","","0.0995","0.1068","","","","","","1.101","","","","has coordinates","179439","2020-10-21","18:00:00","" "4333658","13.1366","0.0006","13.1366","0.0006","8.103","0.0004","90","","90","","120","","1211","0.1","293","2","293","2","","","","","","","","2","R 3 m :H","R 3 -2""","160","Au4.84Zn7.85","","","- Au4.84 Zn7.85 -","- Au4.845 Zn7.855 -","- Au29.07 Zn47.13 -","6","0.333333","","Srinivasa Thimmaiah; Gordon J. Miller","rhombohedrally Distorted γ-Au5-xZn8+y Phases in the Au-Zn System","Inorganic Chemistry","2013","52","","1328","1337","10.1021/ic301933a","","","0.71073","MoKα","","0.0758","0.0694","","","0.1318","0.1357","","","","","","1.228","","","","has coordinates","179439","2020-10-21","18:00:00","" "4333659","13.1345","0.0008","13.1345","0.0008","8.1103","0.0006","90","","90","","120","","1211.7","0.14","293","2","293","2","","","","","","","","2","R 3 m :H","R 3 -2""","160","Au4.58Zn8.12","","","- Au4.58 Zn8.12 -","- Au4.572 Zn8.122 -","- Au27.432 Zn48.732 -","6","0.333333","","Srinivasa Thimmaiah; Gordon J. Miller","rhombohedrally Distorted γ-Au5-xZn8+y Phases in the Au-Zn System","Inorganic Chemistry","2013","52","","1328","1337","10.1021/ic301933a","","","0.71073","MoKα","","0.0527","0.0398","","","0.0773","0.084","","","","","","1.028","","","","has coordinates","179439","2020-10-21","18:00:00","" "4333660","13.133","0.005","13.133","0.005","8.096","0.005","90","","90","","120","","1209.3","1","293","2","293","2","","","","","","","","2","R 3 m :H","R 3 -2""","160","Au4.42Zn8.19","","","- Au4.42 Zn8.19 -","- Au4.4265 Zn8.185 -","- Au26.559 Zn49.11 -","6","0.333333","","Srinivasa Thimmaiah; Gordon J. Miller","rhombohedrally Distorted γ-Au5-xZn8+y Phases in the Au-Zn System","Inorganic Chemistry","2013","52","","1328","1337","10.1021/ic301933a","","","0.71073","MoKα","","0.0844","0.0602","","","0.1046","0.1165","","","","","","1.087","","","","has coordinates","179439","2020-10-21","18:00:00","" "4334360","15.775","0.005","15.775","0.005","13.208","0.005","90","0.005","90","0.005","120","0.005","2846.5","1.7","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C28 H63 Al Ce O7 -","- C28 H69 Al Ce O7 -","- C84 H207 Al3 Ce3 O21 -","3","0.166667","","Johannes Schläfer; Stefan Stucky; Wieland Tyrra; Sanjay Mathur","Heterobi- and Trimetallic Cerium(IV) tert-Butoxides with Mono-, Di-, and Trivalent Metals (M= K(I), Ge(II), Sn(II), Pb(II), Al(III), Fe(III))","Inorganic Chemistry","2013","52","","4002","4010","10.1021/ic400030j","","","0.71073","MoKα","","0.034","0.0339","","","0.0835","0.0844","","","","","","1.091","","","","has coordinates","179446","2020-10-21","18:00:00","" "4334361","15.815","0.005","15.815","0.005","13.272","0.005","90","0.005","90","0.005","120","0.005","2874.8","1.7","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C28 H63 Ce Fe O7 -","- C28 H69 Ce Fe O7 -","- C84 H207 Ce3 Fe3 O21 -","3","0.166667","","Johannes Schläfer; Stefan Stucky; Wieland Tyrra; Sanjay Mathur","Heterobi- and Trimetallic Cerium(IV) tert-Butoxides with Mono-, Di-, and Trivalent Metals (M= K(I), Ge(II), Sn(II), Pb(II), Al(III), Fe(III))","Inorganic Chemistry","2013","52","","4002","4010","10.1021/ic400030j","","","0.71073","MoKα","","0.0397","0.039","","","0.0996","0.1004","","","","","","1.117","","","","has coordinates","179446","2020-10-21","18:00:00","" "4335924","16.5975","0.0006","16.5975","0.0006","10.6852","0.0005","90","","90","","120","","2549.17","0.18","210","2","210","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C12 H34 N3 Na3 O29 U3 -","- C12 H34 N3 Na3 O29 U3 -","- C36 H102 N9 Na9 O87 U9 -","3","0.166667","","Daniel K. Unruh; Kyle Gojdas; Erin Flores; Anna Libo; Tori Z. Forbes","Synthesis and Structural Characterization of Hydrolysis Products within the Uranyl Iminodiacetate and Malate Systems","Inorganic Chemistry","2013","52","","10191","10198","10.1021/ic401705j","","","0.71073","MoKα","","0.0088","0.0088","","","0.023","0.023","","","","","","1.098","","","","has coordinates","176432","2020-10-21","18:00:00","" "4336235","4.2459","0.00007","4.2459","0.00007","10.4382","0.0002","90","","90","","120","","162.966","0.005","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","germanium lithium antimony telluride","germanium lithium antimony telluride","","- Ge0.6 Li0.2 Sb0.2 Te -","- Ge0.6 Li0.2 Sb0.2 Te -","- Ge1.8 Li0.6 Sb0.6 Te3 -","3","0.166667","","Thorsten Schröder; Stefan Schwarzmüller; Christian Stiewe; Johannes de Boor; Markus Hölzel; Oliver Oeckler","The Solid Solution Series (GeTe)x(LiSbTe2)2 (1 <=x<= 11) and the Thermoelectric Properties of (GeTe)11(LiSbTe2)2","Inorganic Chemistry","2013","52","","11288","11294","10.1021/ic401516m","powder diffraction","x-ray","1.54051","CuKα~1~","","","","","","","","0.01625","","1.163","","","","","","","has coordinates","179465","2020-10-21","18:00:00","" "4336236","4.2029","0.00006","4.2029","0.00006","10.536","0.0002","90","","90","","120","","161.178","0.004","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","germanium lithium antimony telluride","germanium lithium antimony telluride","","- Ge0.733 Li0.133 Sb0.133 Te -","- Ge0.733333 Li0.133333 Sb0.133333 Te -","- Ge2.2 Li0.4 Sb0.4 Te3 -","3","0.166667","","Thorsten Schröder; Stefan Schwarzmüller; Christian Stiewe; Johannes de Boor; Markus Hölzel; Oliver Oeckler","The Solid Solution Series (GeTe)x(LiSbTe2)2 (1 <=x<= 11) and the Thermoelectric Properties of (GeTe)11(LiSbTe2)2","Inorganic Chemistry","2013","52","","11288","11294","10.1021/ic401516m","powder diffraction","x-ray","1.54051","CuKα~1~","","","","","","","","0.03165","","0.876","","","","","","","has coordinates","179465","2020-10-21","18:00:00","" "4336406","10.706","0.002","10.706","0.002","4.1205","0.0012","90","","90","","120","","409.01","0.16","296","2","296","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C3 H3 Ce O6 -","- C3 H3 Ce O6 -","- C9 H9 Ce3 O18 -","3","0.166667","","Christoph Hennig; Atsushi Ikeda-Ohno; Werner Kraus; Stephan Weiss; Philip Pattison; Hermann Emerich; Paula M. Abdala; Andreas C. Scheinost","Crystal Structure and Solution Species of Ce(III) and Ce(IV) Formates: From Mononuclear to Hexanuclear Complexes","Inorganic Chemistry","2013","52","","11734","11743","10.1021/ic400999j","","","0.71073","MoKα","","0.0325","0.0325","","","0.0741","0.0741","","","","","","1.176","","","","has coordinates","179467","2020-10-21","18:00:00","" "4340360","4.20935","0.00002","4.20935","0.00002","10.4922","0.0001","90","","90","","120","","161.001","0.0019","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","silver germanium antimony telluride","silver germanium antimony telluride","","- Ag0.067 Ge0.767 Sb0.133 Te -","- Ag0.0666667 Ge0.766667 Sb0.133333 Te -","- Ag0.2 Ge2.3 Sb0.4 Te3 -","3","0.166667","","Schröder, Thorsten; Rosenthal, Tobias; Giesbrecht, Nadja; Nentwig, Markus; Maier, Stefan; Wang, Heng; Snyder, G. Jeffrey; Oeckler, Oliver","Nanostructures in Te/Sb/Ge/Ag (TAGS) Thermoelectric Materials Induced by Phase Transitions Associated with Vacancy Ordering.","Inorganic chemistry","2014","53","14","7722","7729","10.1021/ic5010243","powder diffraction","x-ray","1.54051","CuKα~1~","","","","","","","","0.0147","","0.947","","","","","","","has coordinates","179506","2020-10-21","18:00:00","" "4343722","6.5922","","6.5922","","8.005","","90","","90","","120","","301.268","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","Cs (S O2 F)","","- Cs F O2 S -","- Cs F0.999 O2.001 S -","- Cs3 F2.997 O6.003 S3 -","3","0.166667","","Kessler, U.; van Wuellen, L.; Jansen, M.","Structure of the fluorosulfite anion: rotational disorder of (S O2 F)(-) in the alkali metal fluorosulfites and crystal structures of alpha- and beta-(Cs S O2 F)","Inorganic Chemistry","2001","40","","7040","7046","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "4344206","3.427","","3.427","","26.55","","90","","90","","120","","270.037","","","","","","","","","","","","","4","R 3 m :H","R 3 -2""","160","","(Ti S2) (N H3)","","- H3 N S2 Ti -","- N S2 Ti -","- N3 S6 Ti3 -","3","0.166667","","Chianelli, R.R.; Scanlon, J.C.; Whittingham, M.S.; Gamble, F.R.","Structural studies of the intercalation complexes Ti S2 (N H3) and Ta S2 (N H3)","Inorganic Chemistry","1975","14","","1691","1696","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "4344945","9.2735","0.0013","9.2735","0.0013","34.924","0.006","90","","90","","120","","2601","0.7","400","","400","","","","","","","","","5","R 3 m :H","R 3 -2""","160","Imidazolium Tin Iodide","","","- C3 H5 I3 N2 Sn -","- C3 I3 N2.0001 Sn -","- C27 I27 N18.0009 Sn9 -","9","0.5","","Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites.","Inorganic chemistry","2017","56","1","56","73","10.1021/acs.inorgchem.6b02764","","x-ray","0.71073","MoKα","","0.1046","0.0598","","","0.1223","0.1267","","","","2.99","2.99","2.29","","","","has coordinates","191346","2020-10-21","18:00:00","" "4344954","9.2529","0.0012","9.2529","0.0012","35.06","0.007","90","","90","","120","","2599.6","0.7","400","2","400","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","Acetamidinium Tin Iodide","","","- C2 H7 I3 N2 Sn -","- C1.9999 I3 N2.0001 Sn -","- C17.9991 I27 N18.0009 Sn9 -","9","0.5","","Stoumpos, Constantinos C.; Mao, Lingling; Malliakas, Christos D.; Kanatzidis, Mercouri G.","Structure-Band Gap Relationships in Hexagonal Polytypes and Low-Dimensional Structures of Hybrid Tin Iodide Perovskites.","Inorganic chemistry","2017","56","1","56","73","10.1021/acs.inorgchem.6b02764","","","0.71073","MoKα","","0.079","0.06","","","0.1691","0.1842","","","","","","1.109","","","","has coordinates","191346","2020-10-21","18:00:00","" "4349413","13.26","0.002","13.26","0.002","22.193","0.003","90","","90","","120","","3379.4","0.9","100","2","100.01","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","tris[bis(tert-butylimido)manganese(IV)bis(tert-butylimido)manganese(V) hexafluorophosphate","","- C32 H72 F6 Mn4 N8 P -","- C32.0008 H72.0018 F6 Mn4 N8 P -","- C96.0024 H216.005 F18 Mn12 N24 P3 -","3","0.166667","","Vaddypally, Shivaiah; Jovinelli, Daniel J.; McKendry, Ian G.; Zdilla, Michael J.","Covalent Metal-Metal-Bonded Mn4 Tetrahedron Inscribed within a Four-Coordinate Manganese Cubane Cluster, As Evidenced by Unexpected Temperature-Independent Diamagnetism.","Inorganic chemistry","2017","56","7","3733","3737","10.1021/acs.inorgchem.7b00152","","","0.71073","MoKα","","0.0678","0.0633","","","0.1743","0.1784","","","","","","1.082","","","","has coordinates,has disorder","233963","2020-10-21","18:00:00","" "4503531","7.897","0.003","7.897","0.003","6.757","0.006","90","","90","","120","","364.9","0.4","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Ga3 O7 P -","- Ga3 O7 P -","- Ga9 O21 P3 -","3","0.166667","","Xu, Guogang; Li, Jing; Wang, Jiyang; Zhao, Hongyang; Liu, Hong","Flux Growth and Characterizations of Ga3PO7Single Crystals","Crystal Growth & Design","2008","8","10","3577","","10.1021/cg7012649","","","0.71073","MoKα","","0.0192","0.0192","","","0.0431","0.0431","","","","","","1.208","","","","has coordinates","179569","2020-10-21","18:00:00","" "4510302","10.071","0.003","10.071","0.003","8.824","0.004","90","","90","","120","","775.1","0.5","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","K2.87Na0.13B6O10Br","","","- B6 Br K2.87 Na0.13 O10 -","- B6 Br K2.874 Na0.126 O10 -","- B18 Br3 K8.622 Na0.378 O30 -","3","0.166667","","Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan","Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property","Crystal Growth & Design","2014","14","4","1794","","10.1021/cg4019103","","","0.71073","MoKα","","0.0453","0.0424","","","0.0981","0.1002","","","","","","1.091","","","","has coordinates","179650","2020-10-21","18:00:00","" "4510303","10.05","0.002","10.05","0.002","8.816","0.004","90","","90","","120","","771.1","0.4","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","K2.33Na0.67B6O10Br","","","- B6 Br K2.33 Na0.67 O10 -","- B6 Br K2.322 Na0.678 O10 -","- B18 Br3 K6.966 Na2.034 O30 -","3","0.166667","","Han, Shujuan; Wang, Ying; Pan, Shilie; Dong, Xiaoyu; Wu, Hongping; Han, Jian; Yang, Yun; Yu, Hongwei; Bai, Chunyan","Noncentrosymmetric versus Centrosymmetric: Influence of the Na+Substitution on Structural Transition and Second-Harmonic Generation Property","Crystal Growth & Design","2014","14","4","1794","","10.1021/cg4019103","","","0.71073","MoKα","","0.0206","0.0197","","","0.0474","0.0476","","","","","","0.992","","","","has coordinates","179650","2020-10-21","18:00:00","" "4514448","25.805","0.005","25.805","0.005","6.7837","0.0011","90","","90","","120","","3912.1","1.2","110","2","110","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C24 H5.26 Co6 I2.66 O18 -","- C24 H5.244 Co6 I2.613 O18 -","- C72 H15.732 Co18 I7.839 O54 -","3","0.166667","","Lee, Byeongchan; Chen, Ying-Pin; Park, Jinkyu; Park, Jinhee","Visualization of Iodine Chemisorption Facilitated by Aryl C-H Bond Activation.","ACS applied materials & interfaces","2019","11","29","25817","25823","10.1021/acsami.9b04768","","","0.71073","MoKα","","0.2383","0.1265","","","0.25","0.3096","","","","","","1.008","","","","has coordinates,has disorder","219637","2020-10-21","18:00:00","" "4514449","25.819","0.004","25.819","0.004","6.742","0.0014","90","","90","","120","","3892.2","1.2","100","2","100","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C24 H5.06 Co6 I3.49 O18 -","- C24 H5.055 Co6 I3.561 O18 -","- C72 H15.165 Co18 I10.683 O54 -","3","0.166667","","Lee, Byeongchan; Chen, Ying-Pin; Park, Jinkyu; Park, Jinhee","Visualization of Iodine Chemisorption Facilitated by Aryl C-H Bond Activation.","ACS applied materials & interfaces","2019","11","29","25817","25823","10.1021/acsami.9b04768","","","0.7","synchrotron","","0.0611","0.0593","","","0.1489","0.1501","","","","","","1.045","","","","has coordinates,has disorder","219638","2020-10-21","18:00:00","" "4514451","25.802","0.0017","25.802","0.0017","6.784","0.002","90","","90","","120","","3911.3","1.2","100","2","100","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C24 H4.54 Co6 I5.71 O18 -","- C24 H4.509 Co6 I5.943 O18 -","- C72 H13.527 Co18 I17.829 O54 -","3","0.166667","","Lee, Byeongchan; Chen, Ying-Pin; Park, Jinkyu; Park, Jinhee","Visualization of Iodine Chemisorption Facilitated by Aryl C-H Bond Activation.","ACS applied materials & interfaces","2019","11","29","25817","25823","10.1021/acsami.9b04768","","","0.7","synchrotron","","0.0632","0.0544","","","0.1295","0.1332","","","","","","1.034","","","","has coordinates,has disorder","219640","2020-10-21","18:00:00","" "4516618","15.2032","0.0006","15.2032","0.0006","46.09","0.002","90","","90","","120","","9225.9","0.7","100","2","100","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C53.25 H44 Cl9 Cr3 N10.5 O44.92 -","- C54 H44 Cl9.01 Cr3 N10.5 O45.67 -","- C162 H132 Cl27.03 Cr9 N31.5 O137.01 -","3","0.166667","","Elsaidi, Sameh K.; Mohamed, Mona H.; Loring, John S.; McGrail, Bernard Pete; Thallapally, Praveen K.","Coordination Covalent Frameworks: A New Route for Synthesis and Expansion of Functional Porous Materials.","ACS applied materials & interfaces","2016","8","42","28424","28427","10.1021/acsami.6b11116","","","1.54178","CuKα","","0.1374","0.1109","","","0.2833","0.3143","","","","","","1.061","","","","has coordinates","239407","2020-10-21","18:00:00","" "4518280","12.912","0.003","12.912","0.003","23.67","0.005","90","0.03","90","0.03","120","0.03","3417.6","1.7","296","2","296","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Ag-levyne","","","- Ag7.75 O108 Si54 -","- Ag9.714 O108 Si54 -","- Ag9.714 O108 Si54 -","1","0.0555556","","Cametti, Georgia; Scheinost, Andreas C.; Churakov, Sergey V.","Structural Evolution of Ag-LEV Zeolite upon Heating: An In Situ Single-Crystal X-ray Diffraction (SC-XRD) and X-ray Absorption Spectroscopy (XAS) Study.","ACS omega","2020","5","49","31774","31783","10.1021/acsomega.0c04455","","","0.71073","MoKα","","0.1102","0.0874","","","0.2285","0.2522","","","","","","1.127","","","","has coordinates","260415","2021-01-04","03:06:24","" "4518281","12.9559","0.0018","12.9559","0.0018","23.611","0.005","90","","90","","120","","3432.3","1","498","2","498","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Ag-levyne","","","- Ag9.54 O108.74 Si54 -","- Ag9.495 O108 Si54 -","- Ag9.495 O108 Si54 -","1","0.0555556","","Cametti, Georgia; Scheinost, Andreas C.; Churakov, Sergey V.","Structural Evolution of Ag-LEV Zeolite upon Heating: An In Situ Single-Crystal X-ray Diffraction (SC-XRD) and X-ray Absorption Spectroscopy (XAS) Study.","ACS omega","2020","5","49","31774","31783","10.1021/acsomega.0c04455","","","0.71073","MoKα","","0.1254","0.0645","","","0.1685","0.1967","","","","","","0.908","","","","has coordinates","260415","2021-01-04","03:06:24","" "4518282","13.2131","0.0003","13.2131","0.0003","23.2393","0.001","90","","90","","120","","3513.69","0.19","398","2","398","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Ag-levyne","","","- Ag13.82 O121.24 Si54 -","- Ag14.886 O127.62 Si54 -","- Ag14.886 O127.62 Si54 -","1","0.0555556","","Cametti, Georgia; Scheinost, Andreas C.; Churakov, Sergey V.","Structural Evolution of Ag-LEV Zeolite upon Heating: An In Situ Single-Crystal X-ray Diffraction (SC-XRD) and X-ray Absorption Spectroscopy (XAS) Study.","ACS omega","2020","5","49","31774","31783","10.1021/acsomega.0c04455","","","0.71073","MoKα","","0.085","0.0723","","","0.2013","0.2143","","","","","","1.113","","","","has coordinates","260415","2021-01-04","03:06:24","" "4518284","12.943","0.003","12.943","0.003","23.641","0.005","90","0.03","90","0.03","120","0.03","3429.8","1.7","296","2","296","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Ag-levyne","","","- Ag7.8 O108 Si54 -","- Ag7.728 O108 Si54 -","- Ag7.728 O108 Si54 -","1","0.0555556","","Cametti, Georgia; Scheinost, Andreas C.; Churakov, Sergey V.","Structural Evolution of Ag-LEV Zeolite upon Heating: An In Situ Single-Crystal X-ray Diffraction (SC-XRD) and X-ray Absorption Spectroscopy (XAS) Study.","ACS omega","2020","5","49","31774","31783","10.1021/acsomega.0c04455","","","0.71073","MoKα","","0.1092","0.0812","","","0.224","0.2508","","","","","","1.101","","","","has coordinates","260415","2021-01-04","03:06:24","" "4518285","12.955","0.003","12.955","0.003","23.623","0.005","90","0.03","90","0.03","120","0.03","3433.5","1.7","296","2","296","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Ag-levyne","","","- Ag7.98 O108 Si54 -","- Ag8.511 O108 Si54 -","- Ag8.511 O108 Si54 -","1","0.0555556","","Cametti, Georgia; Scheinost, Andreas C.; Churakov, Sergey V.","Structural Evolution of Ag-LEV Zeolite upon Heating: An In Situ Single-Crystal X-ray Diffraction (SC-XRD) and X-ray Absorption Spectroscopy (XAS) Study.","ACS omega","2020","5","49","31774","31783","10.1021/acsomega.0c04455","","","0.71073","MoKα","","0.1198","0.0758","","","0.2118","0.2416","","","","","","1.092","","","","has coordinates","260415","2021-01-04","03:06:24","" "4518286","13.115","0.0004","13.115","0.0004","23.4675","0.0013","90","","90","","120","","3495.7","0.2","423","2","423","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","Ag-levyne","","","- Ag11.41 O112.23 Si54 -","- Ag11.484 O112.77 Si54 -","- Ag11.484 O112.77 Si54 -","1","0.0555556","","Cametti, Georgia; Scheinost, Andreas C.; Churakov, Sergey V.","Structural Evolution of Ag-LEV Zeolite upon Heating: An In Situ Single-Crystal X-ray Diffraction (SC-XRD) and X-ray Absorption Spectroscopy (XAS) Study.","ACS omega","2020","5","49","31774","31783","10.1021/acsomega.0c04455","","","0.71073","MoKα","","0.0946","0.0862","","","0.2407","0.2491","","","","","","1.126","","","","has coordinates","260415","2021-01-04","03:06:24","" "5000097","15.838","0.001","15.838","0.001","7.1032","0.0002","90","","90","","120","","1543.1","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","Sodium manganese calcium lithium alumoborosilicate fluoride hydroxide *","Elbaite","- Al22.78 B9.11 Ca0.42 F1.81 Fe0.09 H8.62 K0.01 Li3.74 Mn0.84 Na1.69 O91.19 Si17.94 -","- Al22.7799 B9.1095 Ca0.42 F1.8099 Fe0.09 H17.8191 K0.0099 Li3.7395 Mn0.8397 Na1.68 O91.1901 Si17.9406 -","- Al22.7799 B9.1095 Ca0.42 F1.8099 Fe0.09 H17.8191 K0.0099 Li3.7395 Mn0.8397 Na1.68 O91.1901 Si17.9406 -","1","0.0555556","","Donnay, G; Barton, R","Refinement of the Crystal Structure of Elbaite and the Mechanism of Tourmaline Solid Solution","Tschermaks Mineralogische und Petrographische Mitteilungen (-1978)","1972","18","","273","286","","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","176451","2020-10-21","18:00:00","" "5000114","9.619","0.0005","9.619","0.0005","3.1499","0.0003","90","","90","","120","","252.4","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Nickel sulfide - $-beta","Millerite","- Ni S -","- Ni S -","- Ni9 S9 -","9","0.5","","Rajamani, V; Prewitt, C T","The crystal structure of millerite","Canadian Mineralogist","1974","12","","253","257","","","","","","","0.014","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:40","" "7003528","25.806","0.004","25.806","0.004","9.888","0.002","90","","90","","120","","5702.7","1.7","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C14 H30 B10 N2 Ti -","- C14 H30 B10 N2 Ti -","- C126 H270 B90 N18 Ti9 -","9","0.5","","Sit, Mei-Mei; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, structure, and reactivity of Group 4 metallacycles incorporating a Me2C-linked cyclopentadienyl-carboranyl ligand","Dalton Transactions","2008","","11","1454","1464","10.1039/b716929a","","","0.71073","MoKα","","0.0831","0.0541","","","0.1308","0.1447","","","","","","0.956","","","","has coordinates","179739","2020-10-21","18:00:00","" "7003529","26.0448","0.0012","26.0448","0.0012","9.8439","0.001","90","","90","","120","","5782.8","0.7","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C15 H32 B10 N2 Ti -","- C15 H32 B10 N2 Ti -","- C135 H288 B90 N18 Ti9 -","9","0.5","","Sit, Mei-Mei; Chan, Hoi-Shan; Xie, Zuowei","Synthesis, structure, and reactivity of Group 4 metallacycles incorporating a Me2C-linked cyclopentadienyl-carboranyl ligand","Dalton Transactions","2008","","11","1454","1464","10.1039/b716929a","","","0.71073","MoKα","","0.053","0.043","","","0.1052","0.1102","","","","","","0.973","","","","has coordinates","179739","2020-10-21","18:00:00","" "7004547","10.5916","0.0006","10.5916","0.0006","4.0637","0.0005","90","","90","","120","","394.8","0.06","296","2","296","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C3 H3 Nd O6 -","- C3 H3 Nd O6 -","- C9 H9 Nd3 O18 -","3","0.166667","","Lin, Jiao-Min; Guan, Yang-Fan; Wang, Dong-Yao; Dong, Wen; Wang, Xiu-Teng; Gao, Song","Syntheses, structures and properties of seven isomorphous 1D Ln3+complexes Ln(BTA)(HCOO)(H2O)3 (H2BTA = bis(tetrazoly)amine, Ln = Pr, Gd, Eu, Tb, Dy, Er, Yb) and two 3D Ln3+ complexes Ln(HCOO)3 (Ln = Pr, Nd)","Dalton Transactions","2008","","44","6165","6169","10.1039/b808394k","","","0.71073","MoKα","","0.0075","0.0075","","","0.0173","0.0173","","","","","","1.14","","","","has coordinates","179749","2020-10-21","18:00:00","" "7004548","10.6344","0.0002","10.6344","0.0002","4.0806","0.0001","90","","90","","120","","399.651","0.014","296","2","296","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C3 H3 O6 Pr -","- C3 H3 O6 Pr -","- C9 H9 O18 Pr3 -","3","0.166667","","Lin, Jiao-Min; Guan, Yang-Fan; Wang, Dong-Yao; Dong, Wen; Wang, Xiu-Teng; Gao, Song","Syntheses, structures and properties of seven isomorphous 1D Ln3+complexes Ln(BTA)(HCOO)(H2O)3 (H2BTA = bis(tetrazoly)amine, Ln = Pr, Gd, Eu, Tb, Dy, Er, Yb) and two 3D Ln3+ complexes Ln(HCOO)3 (Ln = Pr, Nd)","Dalton Transactions","2008","","44","6165","6169","10.1039/b808394k","","","0.71073","MoKα","","0.0202","0.0202","","","0.0535","0.0535","","","","","","1.361","","","","has coordinates","176453","2020-10-21","18:00:00","" "7005816","8.2595","0.0004","8.2595","0.0004","16.5475","0.0008","90","0.002","90","0.002","120","0.002","977.62","0.08","150","2","150","2","","","","","","","synthesis as described","6","R 3 m :H","R 3 -2""","160","","","","- C6 H18 Cl I N3 P -","- C6 H18 Cl I N3 P -","- C18 H54 Cl3 I3 N9 P3 -","3","0.166667","","Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Pritchard, Robin G.; Safi, Zaki; Sheffield, Joanne M.","Preference for a C3 conformation in tris-dimethylaminophosphonium cations: a comparison of the reactions of (Me2N)3P with I-X (X = Cl, Br, I, CN).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3252","3258","10.1039/b705651f","","x-ray","0.71073","MoKα","","0.0266","0.0231","","","0.0417","0.043","","","","","","1.117","","","","has coordinates","176432","2020-10-21","18:00:00","" "7005818","8.2719","0.0009","8.2719","0.0009","16.646","0.002","90","","90","","120","","986.4","0.19","183","2","183","2","","","","","","","synthesis as described","7","R 3 m :H","R 3 -2""","160","","","","- C6 H18 Br0.5 Cl0.5 I N3 P -","- C6 H18 Br0.51 Cl0.49 I N3 P -","- C18 H54 Br1.53 Cl1.47 I3 N9 P3 -","3","0.166667","","Barnes, Nicholas A.; Godfrey, Stephen M.; Halton, Ruth T. A.; Pritchard, Robin G.; Safi, Zaki; Sheffield, Joanne M.","Preference for a C3 conformation in tris-dimethylaminophosphonium cations: a comparison of the reactions of (Me2N)3P with I-X (X = Cl, Br, I, CN).","Dalton transactions (Cambridge, England : 2003)","2007","","30","3252","3258","10.1039/b705651f","","x-ray","0.71069","MoKα","","0.0261","0.0261","","","0.0612","0.0612","","","","","","1.158","","","","has coordinates","176432","2020-10-21","18:00:00","" "7012553","32.123","0.009","32.123","0.009","9.273","0.002","90","","90","","120","","8287","4","203","2","203","2","","","","","","","synthesis as described","5","R 3 m :H","R 3 -2""","160","","","","- C35 H53 Li N2 O3 -","- C35 H53 Li N2 O3 -","- C315 H477 Li9 N18 O27 -","9","0.5","","Carey, David T.; Cope-Eatough, Elaine K.; Vilaplana-Mafé, Eva; Mair, Francis S.; Pritchard, Robin G.; Warren, John E.; Woods, Rebecca J.","Structures and reactions of monomeric and dimeric lithium diazapentadienyl complexes with electrophiles: synthesis of α-C,C'-dialkyl-β-diimines, and dissolution-reversible synthesis of an α-alkoxylithium-β-diimine","Dalton Transactions","2003","","6","1083","","10.1039/b212079h","","x-ray","0.71073","MoKα","","0.1067","0.0605","","","0.1257","0.1434","","","","","","0.917","","","","has coordinates","213973","2020-10-21","18:00:00","" "7021728","37.0306","0.0007","37.0306","0.0007","18.3039","0.0007","90","","90","","120","","21736.8","1","293","2","293","2","","","","","","","","8","R 3 m :H","R 3 -2""","160","","","","- C12 H57 Cu Mo16 N3 Na5 O76 V2 -","- C12 H30 Cu0.09 Mo16 N3 Na1.01 O71.01 V2 -","- C108 H270 Cu0.81 Mo144 N27 Na9.09 O639.09 V18 -","9","0.5","","Li, Fengyan; Meng, Fanzhi; Ma, Lifang; Xu, Lin; Sun, Zhixia; Gao, Qiao","3D pure inorganic framework based on polymolybdovanadate possessing photoelectric properties.","Dalton transactions (Cambridge, England : 2003)","2013","42","34","12079","12082","10.1039/c3dt51057c","","","0.71073","MoKα","","0.0785","0.0426","","","0.1077","0.1171","","","","","","0.985","","","","has coordinates","179922","2020-10-21","18:00:00","" "7027051","9.2971","0.0009","9.2971","0.0009","6.6646","0.0013","90","","90","","120","","498.88","0.12","150","0.2","150","0.2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C3 H12 Ga N -","- C3 H12 Ga N -","- C9 H36 Ga3 N3 -","3","0.166667","","Brain, Paul T.; Brown, Helen E.; Downs, Anthony J.; Greene, Tim M.; Johnsen, Emma; Parsons, Simon; Rankin, David W. H.; Smart, Bruce A.; Tang, Christina Y.","Molecular structure of trimethylamine‒gallane, Me3N·GaH3: ab initio calculations, gas-phase electron diffraction and single-crystal X-ray diffraction studies †","Journal of the Chemical Society, Dalton Transactions","1998","","21","3685","","10.1039/a806289g","","","0.71073","MoKα","","0.0249","0.0249","","0.0639","0.0639","","","","1.094","1.094","1.094","","","","","has coordinates","179976","2020-10-21","18:00:00","" "7035576","30.13","0.003","30.13","0.003","13.5343","0.0016","90","","90","","120","","10641","2","296","2","296","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","","- C H92 K9 Mn6 O156 Si3 W30 -","- C K9 Mn6 O157.5 Si3 W30 -","- C3 K27 Mn18 O472.5 Si9 W90 -","3","0.166667","","Yang, Ling; Liu, Qisen; Ma, Pengtao; Niu, Jingyang; Wang, Jingping","A CO3(2-)-containing, dimanganese-substituted silicotungstate trimer, K9[H14{SiW10Mn(II)Mn(III)O38}3(CO3)]·39H2O.","Dalton transactions (Cambridge, England : 2003)","2015","44","30","13469","13472","10.1039/c5dt00262a","","","0.71073","MoKα","","0.0382","0.0336","","","0.0811","0.083","","","","","","1.038","","","","has coordinates,has disorder","176428","2020-10-21","18:00:00","" "7040323","30.722","0.002","30.722","","16.0353","0.0012","90","","90","","120","","13107.1","1.3","293","2","293","2","","","","","","","","8","R 3 m :H","R 3 -2""","160","","","","- Cs10 H42 Mn Na3 Nb9 O138 Si3 W27 -","- Cs10 Mn Na3 Nb9 O147 Si3 W27 -","- Cs30 Mn3 Na9 Nb27 O441 Si9 W81 -","3","0.166667","","Wang, Haiying; Liang, Zhijie; Wang, Yaya; Zhang, Dongdi; Ma, Pengtao; Wang, Jingping; Niu, Jingyang","Insight into the reactivity of in situ formed {(NbO2)3SiW9}: synthesis, structure, and solution properties of a trimeric polytungstosilicate trapping a {MnNb9} core.","Dalton transactions (Cambridge, England : 2003)","2016","45","38","15236","15241","10.1039/c6dt02252a","","","0.71073","MoKα","","0.0612","0.0419","","","0.1025","0.1129","","","","","","1.012","","","","has coordinates","208816","2020-10-21","18:00:00","" "7040599","16.8738","0.0012","16.8738","0.0012","6.7163","0.0005","90","","90","","120","","1656.1","0.2","120","2","120","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C10 H33 Cl3 Mo3 O10 -","- C10 H33 Cl3 Mo3 O10 -","- C30 H99 Cl9 Mo9 O30 -","3","0.166667","","Kuznetsov, Denis A.; Bazhenova, Tamara A.; Fedyanin, Ivan V.; Martynenko, Vyacheslav M.; Shestakov, Alexander F.; Petrova, Galina N.; Komarova, Natal'ya S.","Tri-, tetra-, and hexanuclear mixed-valence molybdenum clusters: structural diversity and catalysis of acetylene hydrogenation.","Dalton transactions (Cambridge, England : 2003)","2016","45","41","16309","16316","10.1039/c6dt02965e","","","0.71073","MoKα","","0.0209","0.0183","","","0.0351","0.0361","","","","","","0.991","","","","has coordinates,has disorder","192782","2020-10-21","18:00:00","" "7044055","5.3145","0.0015","5.3145","0.0015","25.494","0.007","90","","90","","120","","623.6","0.3","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- Co2 H3 O9 P3 Pb -","- Co2 H3 O9 P3 Pb -","- Co6 H9 O27 P9 Pb3 -","3","0.166667","","Kovrugin, Vadim M.; Colmont, Marie; Siidra, Oleg I.; Krivovichev, Sergey V.; Colis, Silviu; Mentré, Olivier","The First Lead Cobalt Phosphite, PbCo2(HPO3)3","Dalton Trans.","2017","","","","","10.1039/C7DT02279D","","","0.71073","MoKα","","0.0147","0.0147","","","0.0298","0.0298","","","","","","1.034","","","","has coordinates","200016","2020-10-21","18:00:00","" "7045817","16.177","0.005","16.177","0.005","8.509","0.003","90","","90","","120","","1928.4","1.1","200","2","200","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C22 H34 Cu N7 O2 -","- C22 H34 Cu N7 O2.0001 -","- C66 H102 Cu3 N21 O6.0003 -","3","0.166667","","Chang, Yu-Lun; Lin, Ya-Fan; Chuang, Wan-Jung; Kao, Chai-Lin; Narwane, Manmath; Chen, Hsing-Yin; Chiang, Michael Y.; Hsu, Sodio C. N.","Structure and nitrite reduction reactivity study of bio-inspired copper(i)-nitro complexes in steric and electronic considerations of tridentate nitrogen ligands.","Dalton transactions (Cambridge, England : 2003)","2018","47","15","5335","5341","10.1039/c7dt03843g","","","0.71073","MoKα","","0.0301","0.0274","","","0.0657","0.0669","","","","","","1.065","","","","has coordinates","229855","2020-10-21","18:00:00","" "7056068","10.3062","0.0015","10.3062","0.0015","8.3458","0.0017","90","","90","","120","","767.7","0.2","153.15","","153.15","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- B3 Be3 F4 Li O9 Sr3 -","- B3 Be3 F4 Li O9 Sr3 -","- B9 Be9 F12 Li3 O27 Sr9 -","3","0.166667","","Guo, Shu; Liang, Fei; Liu, Lijuan; Xia, Mingjun; Fang, Zhi; Wu, Ruofei; Wang, Xiaoyang; Lin, Zheshuai; Chen, Chuangtian","LiSr3Be3B3O9F4: A New Ultraviolet Nonlinear Optical Crystal for Fourth-harmonic Generation of Nd:YAG Lasers","New J. Chem.","2017","41","11","4269","4272","10.1039/C7NJ00160F","","","0.710747","MoKα","","0.0283","0.0278","","","0.0649","0.0651","","","","","","1.076","","","","has coordinates","301442","2025-08-04","07:16:06","" "7100121","24.096","0.007","24.096","0.007","7.479","0.003","90","","90","","120","","3761","2","293","2","293","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C48 H57 Cl6 Ir3 N6 -","- C48 H57 Cl6 Ir3 N6 -","- C144 H171 Cl18 Ir9 N18 -","3","0.166667","","Guo-Xin Jin; Chun-Xia Ren; Jianqiang Wang","Route to Multicluster Containing Ancillary ortho-Carborane-1,2-Dithiolato Ligands","Chemical Communications","2005","","","","","10.1039/b505041c","","","","","","","","","","","","","","","","","","","","","has coordinates","180103","2020-10-21","18:00:00","" "7101561","15.88","0.002","15.88","0.002","17.367","0.004","90","","90","","120","","3793","1.1","203","2","203","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- Cs6 H8 Hg4 O4 Sn3 Te13 -","- Cs6 Hg4 O3.99 Sn3 Te13 -","- Cs18 Hg12 O11.97 Sn9 Te39 -","3","0.166667","","Stefanie Dehnen; Andreas Fuchs; Eugen Ruzin","Fine-Tuning of Optical Properties with Salts of Discrete or Polymeric, Heterobimetallic Telluride Anions [M4(μ4-Te)(SnTe4)4]10 (M = Mn, Zn, Cd, Hg) and {[Hg4(μ4-Te)(SnTe4)3]6}","Chemical Communications","2006","","46","","","10.1039/b610833d","","","0.71073","MoKα","","0.0573","0.0474","","","0.1025","0.105","","","","","","0.95","","","","has coordinates","176453","2020-10-21","18:00:00","" "7102647","15.0338","0.0011","15.0338","0.0011","16.512","0.002","90","","90","","120","","3231.9","0.6","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- Cd4 K6 Se13 Sn3 -","- Cd4 K6 Se13 Sn3 -","- Cd12 K18 Se39 Sn9 -","3","0.166667","","Mercouri Kanatzidis; Duck-Young Chung; Nan Ding","K6Cd4Sn3Se13: A polar open-framework compound based on the partially destroyed supertetrahedral [Cd4Sn4Se17]10- cluster","Chemical communications (Cambridge, England)","2004","","10","1170","1171","10.1039/b402686a","","","0.71073","MoKα","","0.0804","0.0453","","","0.1188","0.1344","","","","","","1.044","","","","has coordinates","180128","2020-10-21","18:00:00","" "7109719","15.2032","0.0006","15.2032","0.0006","46.09","0.002","90","","90","","120","","9225.9","0.7","100","2","100","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C53.25 H98.33 Cl9 Cr3 N13 O52.4 -","- C54 H44 Cl9.01 Cr3 N10.5 O45.67 -","- C162 H132 Cl27.03 Cr9 N31.5 O137.01 -","3","0.166667","","Sameh K. Elsaidi; Mona H. Mohamed; Lukasz Wojtas; Amy J. Cairns; Mohamed Eddaoudi; Michael J. Zaworotko","Two-step crystal engineering of porous nets from [Cr/3(mu/3-O)(RCO/2)6] and [Cu/3(mu/3-Cl)(RNH2)/6Cl/6] molecular building blocks","Chem.Commun.","2013","49","","8154","","10.1039/c3cc44133d","","","1.54178","CuKα","","0.1374","0.1109","","","0.2833","0.3143","","","","","","1.061","","","","has coordinates","176453","2020-10-21","18:00:00","" "7111137","11.15","0.005","11.15","0.005","7.586","0.004","90","","90","","120","","816.8","0.7","292","2","292","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C B4 Cl6 O -","- C B4 Cl6 O -","- C3 B12 Cl18 O3 -","3","0.166667","","Jeffery, John C.; Norman, Nicholas C.; Pardoe, Jennifer A. J.; Timms, Peter L.","Synthesis and structures of carbonyl adducts of the boranes B(BX2)3 (X = F, Cl)","Chemical Communications","2000","","23","2367","","10.1039/b007484p","","","0.71073","MoKα","","0.0417","0.0391","","","0.0932","0.0939","","","","","","0.973","","","","has coordinates","180225","2020-10-21","18:00:00","" "7111871","26.2119","0.0014","26.2119","0.0014","36.423","0.003","90","","90","","120","","21672","2","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C30 H18 Cu2 O10 -","- C30 H14 Cu2 O10 -","- C270 H126 Cu18 O90 -","9","0.5","","Jianfeng Cai; Xingtang Rao; Yabing He; Jancan Yu; Chuande Wu; Wei Zhou; Taner Yildirim; Banglin Chen; Guodong Qian","A highly porous NbO type metal-organic framework constructed from an expanded tetracarboxylate","Chem.Commun.","2014","50","","1552","","10.1039/c3cc48747d","","","0.71073","MoKα","","0.1231","0.0665","","","0.1266","0.1397","","","","","","0.944","","","","has coordinates","180232","2020-10-21","18:00:00","" "7126095","14.8782","0.0008","14.8782","0.0008","16.9496","0.0009","90","","90","","120","","3249.3","0.3","296","2","296.15","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C26 H51 Cl4 Co8 N5 O12 -","- C26 H51 Cl4 Co8 N5 O12 -","- C78 H153 Cl12 Co24 N15 O36 -","3","0.166667","","Yu, You-Zhu; Guo, Yu-Hua; Zhang, Yan-Ru; Tian, Xiu-Juan; Zhang, Xian-Ming","Tetrahedral μ4-chloride and in situ generated octahedral μ6-sulfide templating Co8 complexes with different distortions of the cube.","Chemical communications (Cambridge, England)","2020","56","30","4236","4239","10.1039/d0cc01320j","","","0.71073","MoKα","","0.0379","0.0284","","","0.0819","0.1198","","","","","","1.329","","","","has coordinates,has disorder","251569","2020-10-21","18:00:00","" "7127115","6.6973","0.0001","6.6973","0.0001","18.5548","0.0003","90","","90","","120","","720.753","0.019","293","2","293","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- Cu3 F N O10 Pb Se2 -","- Cu3 F N O10 Pb Se2 -","- Cu9 F3 N3 O30 Pb3 Se6 -","3","0.166667","","Zhang, Mengsi; Zhao, Zhiying; Zhang, Wanwan; Li, Jinyang; Huang, Xiaoying; He, Zhangzhen","Pb(OF)Cu3(SeO3)2(NO3): a selenite fluoride nitrate with a breathing kagomé lattice.","Chemical communications (Cambridge, England)","2020","56","80","11965","11968","10.1039/d0cc03684f","","x-ray","0.71073","MoKα","","0.0146","0.0146","","","0.0355","0.0355","","","","","","1.102","","","","has coordinates","260664","2021-01-07","04:47:52","" "7130222","30.6714","0.0012","30.6714","0.0012","14.4221","0.0008","90","","90","","120","","11749.7","0.9","100","","100","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","","- C6 H80 Gd3 K3 Na21 O147 P Sb3 W28 -","- C6 Gd3 K3 Na3 O188.601 P Sb3 W28 -","- C18 Gd9 K9 Na9 O565.804 P3 Sb9 W84 -","3","0.166667","","Tanuhadi, Elias; Rompel, Annette","Trisubstituted 4f – and 4d Tungstoantimonates as artificial Phosphoesterases for Nerve Agent Degradation","Chemical Communications","2022","","","","","10.1039/D2CC02223K","","x-ray","0.71073","MoKα","","0.0569","0.0426","","","0.0876","0.0909","","","","","","0.975","","","","has coordinates,has disorder","276004","2022-06-13","21:54:53","" "7130223","30.6654","0.0007","30.6654","0.0007","14.5899","0.0004","90","","90","","120","","11881.7","0.5","100","","100","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","","- C6 H82 K3 Na21 O148 P Sb3 W28 Y3 -","- C6 K3 Na3 O161.8 P Sb3 W28 Y3 -","- C18 K9 Na9 O485.4 P3 Sb9 W84 Y9 -","3","0.166667","","Tanuhadi, Elias; Rompel, Annette","Trisubstituted 4f – and 4d Tungstoantimonates as artificial Phosphoesterases for Nerve Agent Degradation","Chemical Communications","2022","","","","","10.1039/D2CC02223K","","x-ray","0.71073","MoKα","","0.0415","0.0401","","","0.1048","0.1058","","","","","","1.055","","","","has coordinates,has disorder","276004","2022-06-13","21:54:54","" "7130224","30.5911","0.0006","30.5911","0.0006","14.5883","0.0004","90","","90","","120","","11822.9","0.5","100","","100","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","","- C6 H82 K3 Na21 O148 P Sb3 W28 Y3 -","- C6 K3 Na5.1 O182.42 P Sb3 W28 Y3 -","- C18 K9 Na15.3 O547.26 P3 Sb9 W84 Y9 -","3","0.166667","","Tanuhadi, Elias; Rompel, Annette","Trisubstituted 4f – and 4d Tungstoantimonates as artificial Phosphoesterases for Nerve Agent Degradation","Chemical Communications","2022","","","","","10.1039/D2CC02223K","","x-ray","0.71073","MoKα","","0.0539","0.0452","","","0.1115","0.1171","","","","","","1.017","","","","has coordinates,has disorder","276004","2022-06-13","21:54:54","" "7130225","30.5334","0.0006","30.5334","0.0006","14.4965","0.0004","90","","90","","120","","11704.3","0.5","100","","100","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","","- C6 H80 K3 Na21 O147 P Sb3 W28 Yb3 -","- C6 K3 Na7.5 O194.8 P Sb3 W28 Yb3 -","- C18 K9 Na22.5 O584.4 P3 Sb9 W84 Yb9 -","3","0.166667","","Tanuhadi, Elias; Rompel, Annette","Trisubstituted 4f – and 4d Tungstoantimonates as artificial Phosphoesterases for Nerve Agent Degradation","Chemical Communications","2022","","","","","10.1039/D2CC02223K","","x-ray","0.71073","MoKα","","0.0584","0.0456","","","0.1092","0.1134","","","","","","0.967","","","","has coordinates,has disorder","276004","2022-06-13","21:54:54","" "7130695","10.5223","0.0018","10.5223","0.0018","8.68","0.002","90","","90","","120","","832.3","0.3","296","2","296","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- Ge2 O4 Sr3 Te3 -","- Ge2 O3.9999 Sr3 Te3 -","- Ge6 O11.9997 Sr9 Te9 -","3","0.166667","","Sun, Mengran; Xing, Wenhao; Lee, Ming-Hsien; Yao, Jiyong","Bridging oxygen atoms in trigonal prism units driven strong second-harmonic-generation efficiency in Sr3Ge2O4Te3.","Chemical communications (Cambridge, England)","2022","58","79","11167","11170","10.1039/d2cc03979f","","","0.71073","MoKα","","0.0528","0.0339","","","0.0476","0.053","","","","","","1.051","","","","has coordinates","278397","2022-10-07","00:39:25","" "7153524","31.0859","0.0007","31.0859","0.0007","4.6544","0.0001","90","","90","","120","","3895.12","0.15","150","2","173","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","hexakis(2-pyridylmethyl)cyclotriveratrylene hydrate","","","- C57 H51 N6 O10.5 -","- C57 H48 N6 O10.5 -","- C171 H144 N18 O31.5 -","3","0.166667","","Hardie, Michaele J.; Mills, Rachael M.; Sumby, Christopher J.","Building blocks for cyclotriveratrylene-based coordination networks","Organic & Biomolecular Chemistry","2004","2","20","2958","2964","10.1039/b407165d","","","0.71073","MoKα","","0.0884","0.0831","","","0.2232","0.2296","","","","","","1.125","","","","has coordinates","176453","2020-10-21","18:00:00","" "7205749","10.1153","0.0008","10.1153","0.0008","8.8592","0.0014","90","","90","","120","","785.02","0.15","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- B6 Br K3 O10 -","- B6 Br K3 O10 -","- B18 Br3 K9 O30 -","3","0.166667","","Zhang, Min; Pan, Shi-Lie; Fan, Xiao-Yun; Zhou, Zhong-Xiang; Poeppelmeier, Kenneth R.; Yang, Yun","Crystal growth and optical properties of a noncentrosymmetric haloid borate, K3B6O10Br","CrystEngComm","2011","13","8","2899","","10.1039/c0ce00725k","","","0.71073","MoKα","","0.0275","0.0273","","","0.0637","0.0639","","","","","","1.157","","","","has coordinates","180388","2020-10-21","18:00:00","" "7207099","15.8078","0.0004","15.8078","0.0004","9.2047","0.0003","90","","90","","120","","1991.97","0.1","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- C13.5 H21 O3 -","- C13.5 H22.5 O3 -","- C81 H135 O18 -","6","0.333333","","Cîrcu, Monica; Paşcanu, Vlad; Soran, Albert; Braun, Beatrice; Terec, Anamaria; Socaci, Crina; Grosu, Ion","Solid state supramolecular assemblies of triol podands through H-bonds","CrystEngComm","2012","14","2","632","","10.1039/c1ce05971h","","","0.71069","MoKα","","0.0385","0.0379","","","0.0967","0.0973","","","","","","1.137","","","","has coordinates","176453","2020-10-21","18:00:00","" "7209396","3.459","","3.459","","17.2","","90","","90","","120","","178.222","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Au Si0.92 P0.96","","- Au P0.96 Si0.92 -","- Au P0.96 Si0.92 -","- Au3 P2.88 Si2.76 -","3","0.166667","","Jeitschko, W.; Kaiser, P.","Preparation and crystal structures of the ternary compounds Ag2 Si P2 and Au Si P","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1997","52","","462","468","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00","" "7210683","24.401","0.004","24.401","0.004","11.5733","0.0018","90","","90","","120","","5967.6","1.7","173","2","173","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C12 H31 Cu3 N7 O8 -","- C12 H24 Cu3 N7 O8 -","- C108 H216 Cu27 N63 O72 -","9","0.5","","Xia, Bing; Chen, Zhenxia; Zheng, Qingshu; Zheng, Hua; Deng, Mingli; Ling, Yun; Weng, Linhong; Zhou, Yaming","A flexible porous metal‒azolate framework constructed by [Cu3(μ3-OH)(μ2-O)(triazolate)2]+ building blocks: synthesis, reversible structural transformation and related magnetic properties","CrystEngComm","2013","15","17","3484","","10.1039/c3ce00070b","","","0.71073","MoKα","","0.0615","0.0555","","","0.1499","0.1568","","","","","","1.132","","","","has coordinates","180437","2020-10-21","18:00:00","" "7210684","24.9131","0.0014","24.9131","0.0014","10.8608","0.0012","90","","90","","120","","5837.8","0.8","173","2","173","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C9 H24 Cu3 N6 O9 -","- C9 H24 Cu3 N6 O9 -","- C81 H216 Cu27 N54 O81 -","9","0.5","","Xia, Bing; Chen, Zhenxia; Zheng, Qingshu; Zheng, Hua; Deng, Mingli; Ling, Yun; Weng, Linhong; Zhou, Yaming","A flexible porous metal‒azolate framework constructed by [Cu3(μ3-OH)(μ2-O)(triazolate)2]+ building blocks: synthesis, reversible structural transformation and related magnetic properties","CrystEngComm","2013","15","17","3484","","10.1039/c3ce00070b","","","0.71073","MoKα","","0.0711","0.0658","","","0.1866","0.1902","","","","","","1.154","","","","has coordinates","180437","2020-10-21","18:00:00","" "7215988","7.4241","0.0006","7.4241","0.0006","8.7784","0.0008","90","","90","","120","","419.02","0.06","295","2","295","2","","","290000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium tetrafluoroborate","guanidinium tetrafluoroborate","","- C H6 B F4 N3 -","- C H6 B F4 N3 -","- C3 H18 B3 F12 N9 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0323","0.0319","","","0.0753","0.0757","","","","","","1.171","","","","has coordinates","180490","2020-10-21","18:00:00","" "7215989","7.4121","0.0004","7.4121","0.0004","8.65","0.005","90","","90","","120","","411.6","0.2","295","2","295","2","","","490000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium tetrafluoroborate","guanidinium tetrafluoroborate","","- C H6 B F4 N3 -","- C H6 B F4 N3 -","- C3 H18 B3 F12 N9 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0256","0.0235","","","0.0621","0.0635","","","","","","1.252","","","","has coordinates","180490","2020-10-21","18:00:00","" "7215990","7.4031","0.0004","7.4031","0.0004","8.5486","0.0005","90","","90","","120","","405.74","0.04","295","2","295","2","","","670000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium tetrafluoroborate","guanidinium tetrafluoroborate","","- C H6 B F4 N3 -","- C H6 B F4 N3 -","- C3 H18 B3 F12 N9 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0273","0.0269","","","0.0706","0.0707","","","","","","1.205","","","","has coordinates","180490","2020-10-21","18:00:00","" "7215996","7.5595","0.0006","7.5595","0.0006","8.7694","0.001","90","","90","","120","","434","0.07","295","2","295","2","","","380000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium perchlorate","guanidinium perchlorate","","- C H6 Cl N3 O4 -","- C H6 Cl N3 O4 -","- C3 H18 Cl3 N9 O12 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0625","0.0562","","","0.1191","0.1295","","","","","","1.29","","","","has coordinates","180490","2020-10-21","18:00:00","" "7215997","7.5534","0.0004","7.5534","0.0004","8.6935","0.0017","90","","90","","120","","429.55","0.09","295","2","295","2","","","570000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium perchlorate","guanidinium perchlorate","","- C H6 Cl N3 O4 -","- C H6 Cl N3 O4 -","- C3 H18 Cl3 N9 O12 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0302","0.0299","","","0.0794","0.0796","","","","","","1.308","","","","has coordinates","180490","2020-10-21","18:00:00","" "7215998","7.531","0.0004","7.531","0.0004","8.4767","0.0018","90","","90","","120","","416.35","0.09","295","2","295","2","","","1030000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium perchlorate","guanidinium perchlorate","","- C H6 Cl N3 O4 -","- C H6 Cl N3 O4 -","- C3 H18 Cl3 N9 O12 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0291","0.0292","","","0.0795","0.0794","","","","","","1.32","","","","has coordinates","180490","2020-10-21","18:00:00","" "7215999","7.5123","0.0004","7.5123","0.0004","8.3522","0.0007","90","","90","","120","","408.2","0.05","295","2","295","2","","","1350000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium perchlorate","guanidinium perchlorate","","- C H6 Cl N3 O4 -","- C H6 Cl N3 O4 -","- C3 H18 Cl3 N9 O12 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.057","0.0563","","","0.1513","0.1526","","","","","","1.231","","","","has coordinates","180490","2020-10-21","18:00:00","" "7216000","7.4965","0.0003","7.4965","0.0003","8.2508","0.0006","90","","90","","120","","401.55","0.04","295","2","295","2","","","1730000","","","","","5","R 3 m :H","R 3 -2""","160","guanidinium perchlorate","guanidinium perchlorate","","- C H6 Cl N3 O4 -","- C H6 Cl N3 O4 -","- C3 H18 Cl3 N9 O12 -","3","0.166667","","Szafrański, Marek","Effect of high pressure on the supramolecular structures of guanidinium based ferroelectrics","CrystEngComm","2014","","","","","10.1039/c4ce00697f","","","0.71073","MoKα","","0.0461","0.0457","","","0.1161","0.1164","","","","","","1.256","","","","has coordinates","180491","2020-10-21","18:00:00","" "7218932","10.4466","0.0013","10.4466","0.0013","8.3093","0.0017","90","","90","","120","","785.3","0.2","93","2","93","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","NSBBF","","","- B3 Be3 F4 Na O9 Sr3 -","- B3 Be3 F4 Na O9 Sr3 -","- B9 Be9 F12 Na3 O27 Sr9 -","3","0.166667","","Wang, Xiaoshan; Liu, Lijuan; Wang, Xiaoyang; Bai, Lei; Chen, Chuangtian","Growth and optical properties of the novel nonlinear optical crystal NaSr3Be3B3O9F4","CrystEngComm","2015","17","4","925","","10.1039/C4CE02096K","","","0.71073","MoKα","","0.0305","0.0271","","","0.0632","0.0641","","","","","","0.64","","","","has coordinates","301864","2025-08-22","15:14:38","" "7221391","4.71","","4.71","","31.72","","90","","90","","120","","609.404","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- Li5 Na Sn4 -","- Li5 Na Sn4 -","- Li15 Na3 Sn12 -","3","0.166667","","Volk, K.; Mueller, W.","Li5 Na Sn4 -eine Phase mit gewellten Sn-Sechsecknetzen","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1978","33","","593","596","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "7223343","14.6793","0.0006","14.6793","0.0006","9.5183","0.0005","90","","90","","120","","1776.24","0.14","293","2","293","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C12 H15 Cd3 Cl N6 O10 -","- C12 H12 Cd3 Cl N6 O10.02 -","- C36 H36 Cd9 Cl3 N18 O30.06 -","3","0.166667","","Wang, Jia; Yao, Shuo; Li, Guanghua; Huo, Qisheng; Zhang, Lirong; Liu, Yunling","A Novel Trinuclear Cd(II) Cluster-based Metal‒Organic Framework: Synthesis, Structure and Luminescence Property","RSC Adv.","2015","","","","","10.1039/C5RA22184F","","","0.71073","MoKα","","0.0279","0.0279","","","0.0767","0.0767","","","","","","1.202","","","","has coordinates","170514","2020-10-21","18:00:00","" "7227021","10.099","0.0004","10.099","0.0004","8.858","0.0005","90","","90","","120","","782.39","0.06","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B6 Br0.67 Cl0.33 K3 O10 -","- B6 Br0.651 Cl0.349 K3 O10 -","- B18 Br1.953 Cl1.047 K9 O30 -","3","0.166667","","Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian","Chemical engineering of mixed halide hexaborates as nonlinear optical materials","RSC Adv.","2016","","","","","10.1039/C6RA21584J","","","0.71073","MoKα","","0.0202","0.02","","","0.0483","0.0484","","","","","","1.126","","","","has coordinates","188034","2020-10-21","18:00:00","" "7227022","10.1051","0.0006","10.1051","0.0006","8.855","0.0007","90","","90","","120","","783.07","0.09","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B6 Br0.79 Cl0.21 K3 O10 -","- B6 Br0.792 Cl0.208 K3 O10 -","- B18 Br2.376 Cl0.624 K9 O30 -","3","0.166667","","Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian","Chemical engineering of mixed halide hexaborates as nonlinear optical materials","RSC Adv.","2016","","","","","10.1039/C6RA21584J","","","0.71073","MoKα","","0.0163","0.0163","","","0.0392","0.0392","","","","","","1.156","","","","has coordinates","188035","2020-10-21","18:00:00","" "7227023","10.0938","0.0004","10.0938","0.0004","8.8593","0.0005","90","","90","","120","","781.7","0.06","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B6 Br0.53 Cl0.47 K3 O10 -","- B6 Br0.527 Cl0.473 K3 O10 -","- B18 Br1.581 Cl1.419 K9 O30 -","3","0.166667","","Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian","Chemical engineering of mixed halide hexaborates as nonlinear optical materials","RSC Adv.","2016","","","","","10.1039/C6RA21584J","","","0.71073","MoKα","","0.0127","0.0125","","","0.0325","0.0328","","","","","","1.009","","","","has coordinates","188036","2020-10-21","18:00:00","" "7227024","10.0855","0.0004","10.0855","0.0004","8.8613","0.0004","90","","90","","120","","780.59","0.06","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B6 Br0.25 Cl0.75 K3 O10 -","- B6 Br0.254 Cl0.746 K3 O10 -","- B18 Br0.762 Cl2.238 K9 O30 -","3","0.166667","","Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian","Chemical engineering of mixed halide hexaborates as nonlinear optical materials","RSC Adv.","2016","","","","","10.1039/C6RA21584J","","","0.71073","MoKα","","0.0139","0.0137","","","0.0337","0.0342","","","","","","1.119","","","","has coordinates","188037","2020-10-21","18:00:00","" "7227025","10.0907","0.0004","10.0907","0.0004","8.8573","0.0005","90","","90","","120","","781.04","0.06","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- B6 Br0.43 Cl0.57 K3 O10 -","- B6 Br0.43 Cl0.57 K3 O10 -","- B18 Br1.29 Cl1.71 K9 O30 -","3","0.166667","","Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian","Chemical engineering of mixed halide hexaborates as nonlinear optical materials","RSC Adv.","2016","","","","","10.1039/C6RA21584J","","","0.71073","MoKα","","0.0153","0.0151","","","0.0368","0.0369","","","","","","1.081","","","","has coordinates","188038","2020-10-21","18:00:00","" "7227026","10.0748","0.0007","10.0748","0.0007","8.8641","0.001","90","","90","","120","","779.18","0.12","296","2","296","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- B6 Cl K3 O10 -","- B6 Cl K3 O10 -","- B18 Cl3 K9 O30 -","3","0.166667","","Xia, Mingjun; Hou, Zhanyu; Yang, Yi; Xu, Bo; Liu, Lijuan; Wang, Xiaoyang; Lin, Zheshuai; Li, R.K.; Chen, Chuangtian","Chemical engineering of mixed halide hexaborates as nonlinear optical materials","RSC Adv.","2016","","","","","10.1039/C6RA21584J","","","0.71073","MoKα","","0.0146","0.0146","","","0.0403","0.0403","","","","","","1.153","","","","has coordinates","188039","2020-10-21","18:00:00","" "7227720","7.7079","0.0001","7.7079","0.0001","9.4483","0.0003","90","","90","","120","","486.135","0.018","298","","298","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C3 H3 Cl Li N3 O3 -","- C3 H3 Cl Li N3 O3 -","- C9 H9 Cl3 Li3 N9 O9 -","3","0.166667","","Shemchuk, Oleksii; Braga, Dario; Maini, Lucia; Grepioni, Fabrizia","Anhydrous ionic co-crystals of cyanuric acid with LiCl and NaCl","CrystEngComm","2017","19","10","1366","","10.1039/C7CE00037E","powder diffraction","x-ray","0.775311","Synchrotron","","","","","","","","","0.0725","15.8185","","","","","","","has coordinates","195017","2020-10-21","18:00:00","" "7228728","30.4555","0.0013","30.4555","0.0013","15.9433","0.0013","90","","90","","120","","12806.8","1.3","296","2","293","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- Cs12 H20 Nb9 O130 Si3 W28 -","- Cs12.0001 Nb9 O133 Si3 W28 -","- Cs36.0003 Nb27 O399 Si9 W84 -","3","0.166667","","Wang, Haiying; Hou, Lili; Li, Chen; Zhang, Dongdi; Ma, Pengtao; Wang, Jingping; Niu, Jingyang","Synthesis, structure, and photocatalytic hydrogen evolution of a trimeric Nb/W addendum cluster","RSC Adv.","2017","7","58","36416","","10.1039/C7RA06291E","","","0.71073","MoKα","","0.0543","0.0473","","","0.1173","0.1213","","","","","","1.058","","","","has coordinates,has disorder","208816","2020-10-21","18:00:00","" "7234483","4.2348","0.0011","4.2348","0.0011","10.373","0.003","90","","90","","120","","161.1","0.08","293","2","293","2","","","","","","","","3","R 3 m :H","R 3 -2""","160","germanium antimony telluride","","","- Ge0.77 Sb0.15 Te -","- Ge0.7693 Sb0.1538 Te -","- Ge2.3079 Sb0.4614 Te3 -","3","0.166667","","Felix Fahrnbauer; Stefan Maier; Martin Grundei; Nadja Giesbrecht; Markus Nentwig; Tobias Rosenthal; Gerald Wagner; G. Jeffrey Snyder; Oliver Oeckler","Heterostructures of skutterudites and germanium antimony tellurides - structure analysis and thermoelectric properties of bulk samples","Journal of Materials Chemistry C","2015","3","","10525","10533","10.1039/C5TC01509J","","","0.2946","synchrotron","","0.0314","0.0314","","","0.0885","0.0885","","","","","","1.055","","","","has coordinates","219190","2020-10-21","18:00:00","" "7242064","16.647","0.003","16.647","0.003","7.749","0.003","90","","90","","120","","1859.7","0.9","293","2","293","2","","","","","","","","4","R 3 m :H","R 3 -2""","160","","","","- C24 H27 Br3 N6 -","- C24 H27 Br3 N6 -","- C72 H81 Br9 N18 -","3","0.166667","","Ma, Shuai; Cui, Jing-Wang; Rao, Cai-Hui; Jia, Meng-Ze; Chen, Yun-Rui; Zhang, Jie","Boosting activity of molecular oxygen by pyridinium-based photocatalysts for metal-free alcohol oxidation","Green Chemistry","2021","23","3","1337","1343","10.1039/D0GC03730C","","","0.71073","MoKα","","0.0752","0.0518","","","0.147","0.2245","","","","","","0.886","","","","has coordinates","262669","2021-03-05","02:13:30","" "7251105","15.04","0.004","15.04","0.004","7.918","0.003","90","","90","","120","","1551.1","0.8","296","2","296","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C18 H21 Ag N4 O3 -","- C18 H21 Ag N4 O3.9999 -","- C54 H63 Ag3 N12 O11.9997 -","3","0.166667","","Radiush, Ekaterina A.; Sinelnikov, Gleb O.; Sukhikh, Taisiya Sergeevna; Shurikov, Matvey K.; Shamshurin, Maxim; Semenov, Nikolay A.; Postnikov, Pavel S.; Sokolov, Maksim Nailyevich; Abramov, Pavel A.","Substituent effects on the structure of [Ag(py-R)n](NO3) ionic pairs: structural and computational studies","CrystEngComm","2025","","","","","10.1039/D5CE00829H","","x-ray","0.71073","MoKα","","0.1391","0.0667","","","0.1735","0.198","","","","","","0.979","","","","has coordinates,has disorder","303016","2025-10-28","09:17:05","" "7701228","25.5448","0.0004","25.5448","0.0004","21.0016","0.0004","90","","90","","120","","11868.3","0.3","100","2","100","2","","","","","","","","6","R 3 m :H","R 3 -2""","160","UHM-80","","","- C37 H30 Mg2 N O14.57 P -","- C37 H30 Mg2 N O14.57 P -","- C333 H270 Mg18 N9 O131.13 P9 -","9","0.5","","Stein, Timo; Hoffmann, Frank; Fröba, Michael","A new set of metal-organic frameworks synthesised from diisophthalate-based, 2'-phosphorus-substituted m-terphenyl linker molecules.","Dalton transactions (Cambridge, England : 2003)","2019","48","40","15127","15135","10.1039/c9dt03044a","","x-ray","1.54184","CuKα","","0.0844","0.0785","","","0.1908","0.1975","","","","","","1.093","","","","has coordinates,has disorder","224262","2020-10-21","18:00:00","" "7705076","30.8691","0.0006","30.8691","0.0006","14.8152","0.0004","90","","90","","120","","12226","0.5","150","2","150","2","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","","- C6 H121 Na17 O162 Sb3 Tb3 W28 -","- C6 Na9 O154 Sb3 Tb3 W28 -","- C18 Na27 O462 Sb9 Tb9 W84 -","3","0.166667","","Xu, Xin; Lu, Changtong; Xie, Saisai; Chen, Lijuan; Zhao, Junwei","A trimeric tri-Tb3+ including antimonotungstate and its Eu3+/Tb3+/Dy3+/Gd3+-codoped species with luminescence properties.","Dalton transactions (Cambridge, England : 2003)","2020","49","35","12401","12410","10.1039/d0dt01985b","","","0.71073","MoKα","","0.0627","0.0589","","","0.1556","0.1595","","","","","","1.081","","","","has coordinates","257568","2020-10-21","18:00:00","" "7707455","14.7196","0.0005","14.7196","0.0005","8.367","0.0004","90","","90","","120","","1569.97","0.11","90","","90","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C63 H81 Cl3 Cu3 N9 -","- C63 H81 Cl3 Cu3 N9 -","- C63 H81 Cl3 Cu3 N9 -","1","0.0555556","","Masahara, Shingo; Yokoyama, Hiromichi; Suzaki, Yuji; Ide, Tomohito","Convenient synthesis of copper(I) halide quasi-one-dimensional coordination polymers: their structures and solid-state luminescent properties.","Dalton transactions (Cambridge, England : 2003)","2021","50","25","8889","8898","10.1039/d1dt01571k","","x-ray","1.54184","CuKα","","0.017","0.017","","","0.0456","0.0456","","","","","","1.124","","","","has coordinates,has disorder","267179","2021-07-05","17:39:01","" "8000282","8.4155","0.0006","8.4155","0.0006","11.6376","0.0008","90","","90","","120","","713.76","0.09","273","2","273","2","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","","- C6 H13 Br N O3 -","- C6 H13 Br N O3 -","- C18 H39 Br3 N3 O9 -","3","0.166667","","Tang, Zheng; Gao, Kai-Ge; Sun, Xiao-Fan; Yang, Xing-Ming; Wu, Yi-Zhang; Gao, Zhang-Ran; Cai, Hong-Ling; Wu, X. S.","High-Temperature Molecular Ferroelectric Tris(2-hydroxyethyl) Ammonium Bromide with Dielectric Relaxation.","The journal of physical chemistry letters","2019","","","6650","6655","10.1021/acs.jpclett.9b02875","","","0.71073","MoKα","","0.0188","0.0188","","","0.0436","0.0436","","","","","","0.972","","","","has coordinates","296009","2024-11-20","13:34:13","" "8103511","14.153","","14.153","","60.72","","90","","90","","120","","10533.2","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","Zr3.63 Ti3.51 Ca8.5 Mn2.13 Si2.68 Al0.42 Fe0.93 Na34.43 Sr0.77 Ce1.13 (Si3 O9)4 (Si9 O27)4 Cl (O H)6.84 (H2 O)1.5","","- Al0.42 Ca8.5 Ce1.13 Cl Fe0.93 H9.84 Mn2.13 Na34.43 O152.34 Si50.68 Sr0.77 Ti3.51 Zr3.63 -","- Al0.42 Ca8.502 Ce1.134 Cl Fe0.93 Mn2.13 Na34.431 O152.349 Si50.68 Sr0.768 Ti3.51 Zr3.63 -","- Al1.26 Ca25.506 Ce3.402 Cl3 Fe2.79 Mn6.39 Na103.293 O457.047 Si152.04 Sr2.304 Ti10.53 Zr10.89 -","3","0.166667","","Rastsvetaeva, R.K.; Khomyakov, A.P.; Chapuis, G.","Crystal structure and crystal-chemical features of a new Ti-rich member of the eudialyte family","Zeitschrift fuer Kristallographie (149,1979-)","1999","214","","271","278","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "8103688","7.472","","7.472","","66.75","","90","","90","","120","","3227.42","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Pb2.31 Nb2 O7.31","","- Nb1.95 O7.31004 Pb2.25 -","- Nb1.95 O7.31004 Pb2.25 -","- Nb39 O146.201 Pb45 -","20","1.11111","","Bernotat-Wulf, H.; Hoffmann, W.","Die Kristallstrukturen der Bleiniobate vom Pyrochlor-typ","Zeitschrift fuer Kristallographie (149,1979-)","1982","158","","101","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","150475","2020-10-21","18:00:00","" "8103689","7.46","","7.46","","96.26","","90","","90","","120","","4639.32","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Pb2.44 Nb2 O7.44","","- Nb2 O7.44 Pb2.44 -","- Nb2 O7.44 Pb2.44444 -","- Nb54 O200.88 Pb66 -","27","1.5","","Bernotat-Wulf, H.; Hoffmann, W.","Die Kristallstrukturen der Bleiniobate vom Pyrochlor-typ","Zeitschrift fuer Kristallographie (149,1979-)","1982","158","","101","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","150476","2020-10-21","18:00:00","" "8103710","3.85","","3.85","","37.06","","90","","90","","120","","475.727","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","In2 (Zn S4)","","- In2 S4 Zn -","- In2 S4 Zn -","- In6 S12 Zn3 -","3","0.166667","","Lappe, F.; Niggli, A.; Nitsche, R.; White, J.G.","The crystal structure of In2 Zn S4","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1962","117","","146","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "8104026","14.081","","14.081","","21.79999","","90","","90","","120","","3743.29","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","","- La3.258 Mn1.1 S6 -","- La3.282 Mn1.1 S6 -","- La49.23 Mn16.5 S90 -","15","0.833333","","Cenzual, K.; Gelato, M.N.; Penzo, M.; Parthe, E.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "8104027","13.983","","13.983","","21.68999","","90","","90","","120","","3672.74","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","La3.22 Fe1.1 S6","","- Fe1.1 La3.22 S6 -","- Fe1.1 La3.216 S6 -","- Fe16.5 La48.24 S90 -","15","0.833333","","Cenzual, K.; Gelato, M.N.; Parthe, E.; Penzo, M.","Overlooked trigonal symmetry in structures reported with monoclinic centered Bravais lattices; trigonal description of Li8 Pb3, Pt Te, Pt3 Te4, Pt2 Te3, Li Fe6 Ge4, Li Fe6 Ge5, Ca Ga6 Te10 and La3.266 Mn1.1 S6","Zeitschrift fuer Kristallographie (149,1979-)","1990","193","","217","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","163484","2020-10-21","18:00:00","" "8104227","3.078","","3.078","","279.5","","90","","90","","120","","2293.24","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C111 Si111 -","111","6.16667","","Krishna, P.; Verma, A.R.","An X-Ray diffraction study of silicon carbide structure types ((33)n 34)3 R","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1962","117","","1","15","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "8104265","9.476","","9.476","","3.148","","90","","90","","120","","244.802","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Ni S -","- Ni S -","- Ni9 S9 -","9","0.5","","Kolkmeijer, N.H.; Moesveld, A.L.T.","Ueber die Dichte und Struktur des Millerits (rhomboedrischen Nickelsulfids)","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1931","80","","91","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00","" "8104345","3.079","","3.079","","370.0198","","90","","90","","120","","3037.91","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","Si C","","- C Si -","- C Si -","- C147 Si147 -","147","8.16667","","Ram, U.S.; Dubey, M.; Singh, G.","Structure and growth of an unusual silicon carbide polytype 147R","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1973","137","","341","351","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "8104367","7.135","","7.135","","25.586","","90","","90","","120","","1128.03","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","Ca3 (Si O4) O","","- Ca3 O5 Si -","- Ca3 O4.9864 Si -","- Ca27 O44.8776 Si9 -","9","0.5","","Nishi, F.; Takeuchi, Y.","The rhombohedral structure of tricalcium silicate at 1200 degrees C","Zeitschrift fuer Kristallographie (149,1979-)","1984","168","","197","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00","" "8106809","30.1968","0.0008","30.1968","0.0008","11.4611","0.0003","90","","90","","120","","9050.6","0.4","291","2","291.15","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","","- C38 H45 Cl N4 O Pd -","- C38 H45 Cl N4 O Pd -","- C342 H405 Cl9 N36 O9 Pd9 -","9","0.5","","Wang, Xin-Ling; Li, Hong-Mei","Crystal structure of [2-(4-methoxyphenyl)pyrazine-κ2 C,N) chlorido[N,N′-bis-(2,6-diisopropyl-phenyl)imidazol-2-ylidene-κC)] palladium(II), C38H45ClN4OPd","Zeitschrift für Kristallographie - New Crystal Structures","2016","231","1","145","147","10.1515/ncrs-2015-0063","","","0.71073","MoKα","","0.0481","0.0397","","","0.1011","0.1053","","","","","","1.041","","","","has coordinates,has disorder","281240","2023-03-02","08:26:32","" "9000028","3.073","","3.073","","52.78","","90","","90","","120","","431.643","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","SiC-IV","","","- C7 Si7 -","- C7 Si7 -","- C21 Si21 -","3","0.166667","","Ramsdell, L. S.","The crystal structure of alpha-SiC, type IV","American Mineralogist","1944","29","","431","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9000029","3.073","","3.073","","82.94","","90","","90","","120","","678.297","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","SiC-VI","","","- C11 Si11 -","- C11 Si11 -","- C33 Si33 -","3","0.166667","","Ramsdell, L. S.","The crystal structure of alpha-SiC, type VI","American Mineralogist","1944","29","","519","525","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9000031","3.073","","3.073","","128.15","","90","","90","","120","","1048.03","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","SiC-V","","","- C17 Si17 -","- C17 Si17 -","- C51 Si51 -","3","0.166667","","Ramsdell, L. S.","The crystal structure of alpha-SiC, type V","American Mineralogist","1946","31","","205","205","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9000035","3.073","","3.073","","128.17","","90","","90","","120","","1048.19","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","SiC-51R","","","- C17 Si17 -","- C17 Si17 -","- C51 Si51 -","3","0.166667","","Ramsdell, L. S.","Studies on silicon carbide","American Mineralogist","1947","32","","64","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9000036","3.073","","3.073","","218.65","","90","","90","","120","","1788.16","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","SiC-87R","","","- C29 Si29 -","- C29 Si29 -","- C87 Si87 -","3","0.166667","","Ramsdell, L. S.","Studies on silicon carbide","American Mineralogist","1947","32","","64","82","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9000042","15.951","","15.951","","7.24","","90","","90","","120","","1595.31","","","","","","","","","","","","de Kalb, New York, USA","7","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6 B3 H4 Mg3 Na O31 Si6 -","- Al6 B3 H4 Mg3 Na O31 Si6 -","- Al18 B9 H12 Mg9 Na3 O93 Si18 -","3","0.166667","","Hamburger, G. E.; Buerger, M. J.","The structure of tourmaline","American Mineralogist","1948","33","","532","540","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:29","" "9000216","15.869","","15.869","","7.188","","90","","90","","120","","1567.61","","","","","","","","","","","","Mexquitic, San Luis Potosi, Mexico","8","R 3 m :H","R 3 -2""","160","","","Buergerite","- Al6 B3 F Fe3 H3 Na O30 Si6 -","- Al6 B3 F Fe3 H3 Na O30 Si6 -","- Al18 B9 F3 Fe9 H9 Na3 O90 Si18 -","3","0.166667","","Tippe, A.; Hamilton, W. C.","A neutron-diffraction study of the ferric tourmaline, buergerite","American Mineralogist","1971","56","","101","113","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59","" "9000726","15.967","","15.967","","7.191","","90","","90","","120","","1587.69","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.94 B3 Ca0.36 Cr0.18 Fe0.18 H3 Mg2.04 Na0.46 O31 Si5.64 Ti0.06 V1.11 -","- Al5.94 B3 Ca0.36 Cr0.18 Fe0.18 H3 Mg2.04 Na0.46 O31 Si5.64 Ti0.06 V1.11 -","- Al17.82 B9 Ca1.08 Cr0.54 Fe0.54 H9 Mg6.12 Na1.38 O93 Si16.92 Ti0.18 V3.33 -","3","0.166667","","Foit, F. F.; Rosenberg, P. E.","The structure of vanadium-bearing tourmaline and its implications regarding tourmaline solid solutions","American Mineralogist","1979","64","","788","798","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:39","" "9001206","15.963","","15.963","","7.148","","90","","90","","120","","1577.41","","","","","","","","","","","","","7","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.966 B3 Fe1.902 H3 Na0.54 O30.333 Si5.856 -","- Al6.966 B3 Fe1.902 H3 Na0.54 O30.333 Si5.856 -","- Al20.898 B9 Fe5.706 H9 Na1.62 O90.999 Si17.568 -","3","0.166667","","Foit, F. F.","Crystal chemistry of alkali-deficient schorl and tourmaline structural relationships","American Mineralogist","1989","74","","422","431","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9001513","15.947","","15.947","","7.214","","90","","90","","120","","1588.78","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.078 B3 Ca0.009 Cr0.006 Fe0.612 K0.014 Mg2.274 Mn0.003 Na0.814 O34 Si6 Ti0.03 -","- Al6.078 B3 Ca0.009 Cr0.006 Fe0.612 K0.014 Mg2.274 Mn0.003 Na0.814 O34 Si6 Ti0.03 -","- Al18.234 B9 Ca0.027 Cr0.018 Fe1.836 K0.042 Mg6.822 Mn0.009 Na2.442 O102 Si18 Ti0.09 -","3","0.166667","","Hawthorne, F. C.; MacDonald, D. J.; Burns, P. C.","Reassignment of cation site occupancies in tourmaline: Al-Mg disorder in the crystal structure of dravite","American Mineralogist","1993","78","","265","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41","" "9001517","16.186","","16.186","","7.444","","90","","90","","120","","1688.95","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Povondraite","- B3 Fe9 H1.998 Na O31 Si6 -","- B3 Fe9 H1.998 Na O31 Si6 -","- B9 Fe27 H5.994 Na3 O93 Si18 -","3","0.166667","","Grice, J. D.; Ercit, T. S.; Hawthorne, F. C.","Povondraite, a redefinition of the tourmaline ferridravite Note: Atomic parameters updated by Grice on 11/20/2001.","American Mineralogist","1993","78","","433","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41","" "9001571","15.967","","15.967","","7.126","","90","","90","","120","","1573.34","","","","","","","","","","","","likely White Queen mine, San Diego County, California, USA","9","R 3 m :H","R 3 -2""","160","","","Foitite","- Al6.891 B3 Fe1.599 Li0.219 Mg0.051 Mn0.24 Na0.25 O31 Si6 -","- Al6.891 B3 Fe1.599 Li0.219 Mg0.051 Mn0.24 Na0.25 O31 Si6 -","- Al20.673 B9 Fe4.797 Li0.657 Mg0.153 Mn0.72 Na0.75 O93 Si18 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.; Grice, J. D.","Foitite, _[Fe2(Al,Fe)]Al6Si6O18(BO3)3(OH)4, a new alkali-deficient tourmaline: Description and crystal structure","American Mineralogist","1993","78","","1299","1303","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:41","" "9001968","15.77","","15.77","","7.085","","90","","90","","120","","1525.93","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Rossmanite","- Al8.16 B3 Li0.84 Na0.43 O31 Si6 -","- Al8.16 B3 Li0.84 Na0.43 O31 Si6 -","- Al24.48 B9 Li2.52 Na1.29 O93 Si18 -","3","0.166667","","Selway, J. B.; Novak, M.; Hawthorne, F. C.; Cerny, P.; Ottolini, L.; Kyser, T. K.","Rossmanite, _(LiAl2)Al6(Si6O18)(BO3)3(OH)4, a new alkali-deficient tourmaline: Description and crystal structure","American Mineralogist","1998","83","","896","900","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:32","" "9002170","15.939","","15.939","","7.146","","90","","90","","120","","1572.23","","","","","","","","","","","","Madagascar","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al7.014 B3 Ca0.1 F0.302 Fe1.233 H3.465 K0.043 Li0.006 Mg0.846 Na0.711 O30.698 Si5.832 Ti0.048 V0.006 Zn0.006 -","- Al7.014 B3 Ca0.1 F0.302 Fe1.233 H3.465 K0.043 Li0.006 Mg0.846 Na0.711 O30.698 Si5.832 Ti0.048 V0.006 Zn0.006 -","- Al21.042 B9 Ca0.3 F0.906 Fe3.699 H10.395 K0.129 Li0.018 Mg2.538 Na2.133 O92.094 Si17.496 Ti0.144 V0.018 Zn0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample 108749","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002171","15.963","","15.963","","7.154","","90","","90","","120","","1578.73","","","","","","","","","","","","Sebago Granite, North Windham, Oxford County, Maine, USA","14","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.576 B3 Ca0.031 F0.355 Fe1.764 H3.2 K0.03 Li0.021 Mg0.528 Mn0.015 Na0.608 O30.645 Si6 Ti0.081 -","- Al6.576 B3 Ca0.031 F0.355 Fe1.764 H3.2 K0.03 Li0.021 Mg0.528 Mn0.015 Na0.608 O30.645 Si6 Ti0.081 -","- Al19.728 B9 Ca0.093 F1.065 Fe5.292 H9.6 K0.09 Li0.063 Mg1.584 Mn0.045 Na1.824 O91.935 Si18 Ti0.243 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample DLux1","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002172","15.915","","15.915","","7.187","","90","","90","","120","","1576.49","","","","","","","","","","","","Dunton mine, Newry, Oxford County, Maine, USA","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.072 B3 Ca0.37 Cr0.009 F0.134 Fe0.549 H3.018 K0.027 Li0.006 Mg2.538 Na0.418 O30.866 Si6 Ti0.036 V0.009 -","- Al6.072 B3 Ca0.37 Cr0.009 F0.134 Fe0.549 H3.018 K0.027 Li0.006 Mg2.538 Na0.418 O30.866 Si6 Ti0.036 V0.009 -","- Al18.216 B9 Ca1.11 Cr0.027 F0.402 Fe1.647 H9.054 K0.081 Li0.018 Mg7.614 Na1.254 O92.598 Si18 Ti0.108 V0.027 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample LCW2356","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002173","15.946","","15.946","","7.157","","90","","90","","120","","1576.03","","","","","","","","","","","","Harney Peak Granite, Custer County, South Dakota, USA","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.639 B3 Ca0.027 F0.204 Fe1.671 H3.396 K0.025 Mg0.636 Mn0.012 Na0.54 O30.796 Si6 Ti0.009 V0.006 Zn0.006 -","- Al6.639 B3 Ca0.027 F0.204 Fe1.671 H3.396 K0.025 Mg0.636 Mn0.012 Na0.54 O30.796 Si6 Ti0.009 V0.006 Zn0.006 -","- Al19.917 B9 Ca0.081 F0.612 Fe5.013 H10.188 K0.075 Mg1.908 Mn0.036 Na1.62 O92.388 Si18 Ti0.027 V0.018 Zn0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample HP2-1","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002174","15.935","","15.935","","7.16","","90","","90","","120","","1574.52","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.029 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.029 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al19.548 B9 Ca0.468 Cr0.027 F0.18 Fe3.087 H9.282 K0.045 Mg4.077 Mn0.018 Na1.044 O92.82 Si18 Ti0.207 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample O-T16-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002175","15.934","","15.934","","7.167","","90","","90","","120","","1575.86","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.567 B3 Ca0.016 F0.301 Fe1.05 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al6.567 B3 Ca0.016 F0.301 Fe1.05 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al19.701 B9 Ca0.048 F0.903 Fe3.15 H9.702 K0.045 Li0.018 Mg3.915 Mn0.054 Na2.052 O92.097 Si18 Ti0.072 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample SmFalls","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002176","15.935","","15.935","","7.164","","90","","90","","120","","1575.4","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.606 B3 Ca0.017 F0.106 Fe1.047 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al6.606 B3 Ca0.017 F0.106 Fe1.047 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al19.818 B9 Ca0.051 F0.318 Fe3.141 H9.123 K0.12 Mg3.726 Na1.599 O92.682 Si18 Ti0.252 V0.045 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample Ru-T17-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002177","15.945","","15.945","","7.169","","90","","90","","120","","1578.48","","","","","","","","","","","","","16","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.318 B3 Ca0.061 Cr0.006 F0.331 Fe0.789 H2.682 K0.031 Li0.006 Mg1.734 Mn0.006 Na0.626 O30.669 Si6 Ti0.123 V0.009 -","- Al6.318 B3 Ca0.061 Cr0.006 F0.331 Fe0.789 H2.682 K0.031 Li0.006 Mg1.734 Mn0.006 Na0.626 O30.669 Si6 Ti0.123 V0.009 -","- Al18.954 B9 Ca0.183 Cr0.018 F0.993 Fe2.367 H8.046 K0.093 Li0.018 Mg5.202 Mn0.018 Na1.878 O92.007 Si18 Ti0.369 V0.027 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample Ru-T18-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002178","15.965","","15.965","","7.199","","90","","90","","120","","1589.06","","","","","","","","","","","","","14","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.439 B3 Ca0.368 F0.495 Fe1.158 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al5.439 B3 Ca0.368 F0.495 Fe1.158 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al16.317 B9 Ca1.104 F1.485 Fe3.474 H9.06 K0.087 Li0.054 Mg6.876 Mn0.036 Na1.413 O91.515 Si18 Ti0.099 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample #32008","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002794","10.8112","","10.8112","","27.3296","","90","","90","","120","","2766.38","","","","","","","","","","","","","14","R 3 m :H","R 3 -2""","160","","","Vicanite-(Ce)","- Al0.177 As1.19 B4 Ca8.01 Ce2.328 F8.749 Fe0.823 H La2.214 Na0.583 O38.461 P0.227 Si6 Th2.448 -","- Al0.177 As1.19 B4 Ca8.01 Ce2.328 F8.749 Fe0.823 H0.42 La2.214 Na0.583 O38.461 P0.227 Si6 Th2.448 -","- Al0.531 As3.57 B12 Ca24.03 Ce6.984 F26.247 Fe2.469 H1.26 La6.642 Na1.749 O115.383 P0.681 Si18 Th7.344 -","3","0.166667","","Ballirano, P.; Callegari, A.; Caucia, F.; Maras, A.; Mazzi, F.; Ungaretti, L.","The crystal structure of vicanite - (Ce), a borosilicate showing an unusual (Si3B3O18) polyanion","American Mineralogist","2002","87","","1139","1143","","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:43","" "9002824","16.017","","16.017","","7.256","","90","","90","","120","","1612.09","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Schorl","- Al4.56 B3 Ca0.48 F0.18 Fe2.04 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al4.56 B3 Ca0.48 F0.18 Fe2.04 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al13.68 B9 Ca1.44 F0.54 Fe6.12 H18.54 K0.03 Mg6.57 Na1.47 O92.46 Si18 Ti0.63 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 1 from Madagascar Note: intermediate between feruvite and schorl","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002825","15.983","","15.983","","7.152","","90","","90","","120","","1582.25","","","","","","","","","","","","Alto Lighona pegmatite field, Zambezia, Mozambique","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.75 B3 Ca0.03 F0.15 Fe2.01 H6.85 K0.01 Li0.33 Mg0.06 Mn0.18 Na0.64 O30.85 Si5.76 Ti0.06 Zn0.03 -","- Al6.75 B3 Ca0.03 F0.15 Fe2.01 H6.85 K0.01 Li0.33 Mg0.06 Mn0.18 Na0.64 O30.85 Si5.76 Ti0.06 Zn0.03 -","- Al20.25 B9 Ca0.09 F0.45 Fe6.03 H20.55 K0.03 Li0.99 Mg0.18 Mn0.54 Na1.92 O92.55 Si17.28 Ti0.18 Zn0.09 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 2 from Alto Lighona pegmatite field, Zambezia, Mozambique","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9002826","15.921","","15.921","","7.137","","90","","90","","120","","1566.7","","","","","","","","","","","","a pegmatite at Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al6.78 B3 Ca0.01 F0.55 Fe0.9 H3.42 K0.01 Li0.66 Mg0.6 Na0.81 O30.45 Si5.76 Ti0.06 -","- Al6.78 B3 Ca0.01 F0.55 Fe0.9 H3.42 K0.01 Li0.66 Mg0.6 Na0.81 O30.45 Si5.76 Ti0.06 -","- Al20.34 B9 Ca0.03 F1.65 Fe2.7 H10.26 K0.03 Li1.98 Mg1.8 Na2.43 O91.35 Si17.28 Ti0.18 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 3 from a pegmatite at Minas Gerais, Brazil","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:17","" "9003067","15.9466","","15.9466","","7.1384","","90","","90","","120","","1572.06","","","","","","","","","","","","","11","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.308 B3 Ca0.011 Fe0.021 H3 K0.002 Li0.378 Mn1.233 Na0.693 O31 Si5.928 -","- Al7.308 B3 Ca0.011 Fe0.021 H3 K0.002 Li0.378 Mn1.233 Na0.693 O31 Si5.928 -","- Al21.924 B9 Ca0.033 Fe0.063 H9 K0.006 Li1.134 Mn3.699 Na2.079 O93 Si17.784 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Rossman, G. R.; London, D.; Fritz, E. A.","Mn-rich tourmaline from Austria: structure, chemistry, optical spectra, and relations to synthetic solid solutions Sample BT from Eibenstein an der Thaya, Lower Austria","American Mineralogist","2003","88","","1369","1376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:06","" "9003068","15.941","","15.941","","7.136","","90","","90","","120","","1570.42","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.407 B3 Ca0.032 Fe0.018 H3 K0.004 Li0.483 Mn1.143 Na0.773 O31 Si5.826 Ti0.006 -","- Al7.407 B3 Ca0.032 Fe0.018 H3 K0.004 Li0.483 Mn1.143 Na0.773 O31 Si5.826 Ti0.006 -","- Al22.221 B9 Ca0.096 Fe0.054 H9 K0.012 Li1.449 Mn3.429 Na2.319 O93 Si17.478 Ti0.018 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Rossman, G. R.; London, D.; Fritz, E. A.","Mn-rich tourmaline from Austria: structure, chemistry, optical spectra, and relations to synthetic solid solutions Sample P6 from Eibenstein an der Thaya, Lower Austria","American Mineralogist","2003","88","","1369","1376","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:39:53","" "9003356","15.7537","","15.7537","","7.0707","","90","","90","","120","","1519.7","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.622 B3.648 H3 Na0.91 O31 Si5.352 -","- Al8.622 B3.648 H3 Na0.91 O31 Si5.352 -","- Al25.866 B10.944 H9 Na2.73 O93 Si16.056 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T1","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:06","" "9003357","15.7713","","15.7713","","7.076","","90","","90","","120","","1524.24","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.718 B3.57 H3 Na0.92 O31 Si5.43 -","- Al8.718 B3.57 H3 Na0.92 O31 Si5.43 -","- Al26.154 B10.71 H9 Na2.76 O93 Si16.29 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T2","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:06","" "9003358","15.7959","","15.7959","","7.0815","","90","","90","","120","","1530.19","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.904 B3.51 H3 Na0.94 O31 Si5.49 -","- Al8.904 B3.51 H3 Na0.94 O31 Si5.49 -","- Al26.712 B10.53 H9 Na2.82 O93 Si16.47 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T3","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:06","" "9003359","15.8472","","15.8472","","7.0988","","90","","90","","120","","1543.91","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al9 B3.378 H3 Na0.99 O31 Si5.622 -","- Al9.282 B3.378 H3 Na0.99 O31 Si5.622 -","- Al27.846 B10.134 H9 Na2.97 O93 Si16.866 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T4","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003360","15.9013","","15.9013","","7.1213","","90","","90","","120","","1559.39","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al9 B3.354 H6 Na0.9 O31 Si5.646 -","- Al9.858 B3.354 H6 Na0.9 O31 Si5.646 -","- Al29.574 B10.062 H18 Na2.7 O93 Si16.938 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T5","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","285096","2023-07-08","08:53:35","" "9003558","10.7108","","10.7108","","27.0398","","90","","90","","120","","2686.45","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","","Okanoganite-(Y)","- B3 Ca2.64 Ce4.41 F10 Fe0.77 H4 Na O38 P0.6 Si6.4 Th0.39 Ti0.23 Y7.56 -","- B3 Ca2.64 Ce4.41 F10 Fe0.77 H4 Na O38 P0.6 Si6.4 Th0.39 Ti0.23 Y7.56 -","- B9 Ca7.92 Ce13.23 F30 Fe2.31 H12 Na3 O114 P1.8 Si19.2 Th1.17 Ti0.69 Y22.68 -","3","0.166667","","Boiocchi, M.; Callegari, A.; Ottolini, L.; Maras, A.","The chemistry and crystal structure of okanoganite-(Y) and comparison with vicanite-(Ce) Sample: Golden Horn batholith near Washington Pass, Okanogan County","American Mineralogist","2004","89","","1540","1545","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36","" "9003640","15.8031","","15.8031","","7.0877","","90","","90","","120","","1532.92","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Rossmanite","- Al8.982 B3.324 H5 Na0.484 O31 Si5.676 -","- Al8.982 B3.324 H3 Na0.484 O31 Si5.676 -","- Al26.946 B9.972 H9 Na1.452 O93 Si17.028 -","3","0.166667","","Ertl, A.; Rossman, G. R.; Hughes, J. M.; Prowatke, S.; Ludwig, T.","Mn-bearing ""oxy-rossmanite"" with tetrahedrally-coordinated Al and B from Austria: Structure, chemistry, and infrared and optical spectroscopic study Sample: REDT1 from Eibenstein an der Thaya, Lower Austria Reported formula: (Na.46 Ca.01) (Al2.37 Li.33 Mn2+.25 Fe2+.04 Ti4+.01) Al6 (Si5.47 Al.28 B.25) O18 (BO3)3 [(OH)2.85 O.15] [O.86 (OH).10 F.04] Tourmaline","American Mineralogist","2005","90","","481","487","10.2138/am.2005.1683","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33","" "9003641","15.8171","","15.8171","","7.0935","","90","","90","","120","","1536.9","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Rossmanite","- Al9 B3.39 H3 Na0.478 O31 Si5.61 -","- Al9 B3.39 H3 Na0.478 O31 Si5.61 -","- Al27 B10.17 H9 Na1.434 O93 Si16.83 -","3","0.166667","","Ertl, A.; Rossman, G. R.; Hughes, J. M.; Prowatke, S.; Ludwig, T.","Mn-bearing ""oxy-rossmanite"" with tetrahedrally-coordinated Al and B from Austria: Structure, chemistry, and infrared and optical spectroscopic study Sample: REDT4 from Eibenstein an der Thaya, Lower Austria Reported formula: (Na.46 Ca.01) (Al2.35 Li.32 Mn2+.28 Fe2+.04 Ti4+.01) Al6 (Si5.51 Al.25 B.24) O18 (BO3)3 [(OH)2.80 O.20] [O.86 (OH).10 F.04] Tourmaline","American Mineralogist","2005","90","","481","487","10.2138/am.2005.1683","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33","" "9003817","15.8232","","15.8232","","7.096","","90","","90","","120","","1538.62","","","","","","","","","","","","Elba, Italy","11","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.665 B3.09 Ca0.125 F0.51 Fe0.042 H3.637 Li1.248 Mn0.045 Na0.558 O30.49 Si5.91 -","- Al7.665 B3.09 Ca0.125 F0.51 Fe0.042 H3.637 Li1.248 Mn0.045 Na0.558 O30.49 Si5.91 -","- Al22.995 B9.27 Ca0.375 F1.53 Fe0.126 H10.911 Li3.744 Mn0.135 Na1.674 O91.47 Si17.73 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: Elb2rim","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9003818","15.9055","","15.9055","","7.127","","90","","90","","120","","1561.46","","","","","","","","","","","","Elba, Italy","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.23 B3.006 Ca0.021 F0.648 H3.352 K0.008 Li0.849 Mn0.897 Na0.786 O30.352 Si5.976 Ti0.033 Zn0.009 -","- Al7.23 B3.006 Ca0.021 F0.648 H3.352 K0.008 Li0.849 Mn0.897 Na0.786 O30.352 Si5.976 Ti0.033 Zn0.009 -","- Al21.69 B9.018 Ca0.063 F1.944 H10.056 K0.024 Li2.547 Mn2.691 Na2.358 O91.056 Si17.928 Ti0.099 Zn0.027 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: Tsl2y","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:45","" "9003819","15.9137","","15.9137","","7.1302","","90","","90","","120","","1563.78","","","","","","","","","","","","Elba, Italy","13","R 3 m :H","R 3 -2""","160","","","Mn-foitite","- Al7.251 B3.024 Ca0.025 F0.525 H3.388 K0.004 Li0.78 Mn0.978 Na0.776 O30.475 Si5.922 Ti0.033 Zn0.012 -","- Al7.251 B3.024 Ca0.025 F0.525 H3.388 K0.004 Li0.78 Mn0.978 Na0.776 O30.475 Si5.922 Ti0.033 Zn0.012 -","- Al21.753 B9.072 Ca0.075 F1.575 H10.164 K0.012 Li2.34 Mn2.934 Na2.328 O91.425 Si17.766 Ti0.099 Zn0.036 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: Tsl2z","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:48","" "9003820","15.9243","","15.9243","","7.1323","","90","","90","","120","","1566.32","","","","","","","","","","","","Elba, Italy","12","R 3 m :H","R 3 -2""","160","","","Mn-foitite","- Al7.269 B3 Ca0.029 F0.538 H3.393 K0.009 Li0.711 Mn1.074 Na0.758 O30.462 Si5.904 Ti0.042 -","- Al7.269 B3 Ca0.029 F0.538 H3.393 K0.009 Li0.711 Mn1.074 Na0.758 O30.462 Si5.904 Ti0.042 -","- Al21.807 B9 Ca0.087 F1.614 H10.179 K0.027 Li2.133 Mn3.222 Na2.274 O91.386 Si17.712 Ti0.126 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: Tsl2w","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:49","" "9003821","15.9303","","15.9303","","7.1341","","90","","90","","120","","1567.9","","","","","","","","","","","","Elba, Italy","12","R 3 m :H","R 3 -2""","160","","","Mn-foitite","- Al7.305 B3 Ca0.022 F0.429 H3.382 K0.003 Li0.573 Mn1.161 Na0.737 O30.571 Si5.922 Ti0.039 -","- Al7.305 B3 Ca0.022 F0.429 H3.382 K0.003 Li0.573 Mn1.161 Na0.737 O30.571 Si5.922 Ti0.039 -","- Al21.915 B9 Ca0.066 F1.287 H10.146 K0.009 Li1.719 Mn3.483 Na2.211 O91.713 Si17.766 Ti0.117 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: sl2x","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9003822","15.9398","","15.9398","","7.1363","","90","","90","","120","","1570.25","","","","","","","","","","","","Elba, Italy","12","R 3 m :H","R 3 -2""","160","","","Mn-foitite","- Al7.233 B3 Ca0.025 F0.388 H3.252 K0.004 Li0.444 Mn1.299 Na0.686 O30.612 Si5.982 Ti0.042 -","- Al7.233 B3 Ca0.025 F0.388 H3.252 K0.004 Li0.444 Mn1.299 Na0.686 O30.612 Si5.982 Ti0.042 -","- Al21.699 B9 Ca0.075 F1.164 H9.756 K0.012 Li1.332 Mn3.897 Na2.058 O91.836 Si17.946 Ti0.126 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: Tsl2m","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9003823","15.9461","","15.9461","","7.138","","90","","90","","120","","1571.87","","","","","","","","","","","","Elba, Italy","12","R 3 m :H","R 3 -2""","160","","","Mn-foitite","- Al7.278 B3 Ca0.016 F0.409 H3.392 K0.007 Li0.447 Mn1.311 Na0.673 O30.591 Si5.922 Ti0.042 -","- Al7.278 B3 Ca0.016 F0.409 H3.392 K0.007 Li0.447 Mn1.311 Na0.673 O30.591 Si5.922 Ti0.042 -","- Al21.834 B9 Ca0.048 F1.227 H10.176 K0.021 Li1.341 Mn3.933 Na2.019 O91.773 Si17.766 Ti0.126 -","3","0.166667","","Bosi, F.; Agrosi, G.; Lucchesi, S.; Melchiorre, G.; Scandale, E.","Mn-tourmaline from island of Elba (Italy): Crystal chemistry. Sample: Tsl2g","American Mineralogist","2005","90","","1661","1668","10.2138/am.2005.1852","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9003825","15.8318","","15.8318","","7.0998","","90","","90","","120","","1541.12","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","10","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.606 B3 Ca0.018 F0.319 H3.762 Li1.363 Mn0.031 Na0.549 O30.681 Si6 -","- Al7.6059 B3 Ca0.018 F0.319 H3.762 Li1.3629 Mn0.0309 Na0.549 O30.681 Si6 -","- Al22.8177 B9 Ca0.054 F0.957 H11.286 Li4.0887 Mn0.0927 Na1.647 O92.043 Si18 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: 66c","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45","" "9003826","15.8343","","15.8343","","7.1007","","90","","90","","120","","1541.81","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","11","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.587 B3 Ca0.04 F0.381 H3.632 K0.009 Li1.385 Mn0.029 Na0.515 O30.619 Si6 -","- Al7.587 B3 Ca0.04 F0.381 H3.6319 K0.009 Li1.3851 Mn0.0291 Na0.515 O30.619 Si6 -","- Al22.761 B9 Ca0.12 F1.143 H10.8957 K0.027 Li4.1553 Mn0.0873 Na1.545 O91.857 Si18 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: 61Rda","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45","" "9003827","15.8468","","15.8468","","7.1058","","90","","90","","120","","1545.35","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","10","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.514 B3.044 F0.626 Fe0.194 H3.573 Li1.25 Mn0.043 Na0.674 O30.374 Si5.956 -","- Al7.5141 B3.0438 F0.626 Fe0.1941 H3.5729 Li1.2501 Mn0.0429 Na0.674 O30.374 Si5.9562 -","- Al22.5423 B9.1314 F1.878 Fe0.5823 H10.7187 Li3.7503 Mn0.1287 Na2.022 O91.122 Si17.8686 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: 60fc","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003828","15.8528","","15.8528","","7.1083","","90","","90","","120","","1547.06","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","11","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.459 B3.034 F0.503 Fe0.121 H3.713 Li1.282 Mg0.125 Mn0.096 Na0.625 O30.497 Si5.966 -","- Al7.4559 B3.0342 F0.503 Fe0.1209 H3.713 Li1.2819 Mg0.1251 Mn0.096 Na0.625 O30.497 Si5.9658 -","- Al22.3677 B9.1026 F1.509 Fe0.3627 H11.139 Li3.8457 Mg0.3753 Mn0.288 Na1.875 O91.491 Si17.8974 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: 62ha","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003829","15.8801","","15.8801","","7.1169","","90","","90","","120","","1554.28","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.356 B3.004 Ca0.032 F0.516 Fe0.106 H6.484 K0.005 Li1.107 Mn0.43 Na0.661 O33.484 Si6 -","- Al7.3557 B3.0042 Ca0.032 F0.516 Fe0.1059 H6.484 K0.005 Li1.107 Mn0.4302 Na0.661 O33.484 Si5.9958 -","- Al22.0671 B9.0126 Ca0.096 F1.548 Fe0.3177 H19.452 K0.015 Li3.321 Mn1.2906 Na1.983 O100.452 Si17.9874 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: 64gh","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003830","15.901","","15.901","","7.1238","","90","","90","","120","","1559.88","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.082 B3.014 F0.754 Fe0.795 H3.332 K0.005 Li0.927 Mg0.106 Mn0.072 Na0.841 O30.246 Si5.969 Ti0.035 -","- Al7.0818 B3.0138 F0.754 Fe0.795 H3.3321 K0.005 Li0.927 Mg0.1059 Mn0.072 Na0.841 O30.246 Si5.9688 Ti0.0351 -","- Al21.2454 B9.0414 F2.262 Fe2.385 H9.9963 K0.015 Li2.781 Mg0.3177 Mn0.216 Na2.523 O90.738 Si17.9064 Ti0.1053 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L4e","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45","" "9003831","15.9285","","15.9285","","7.1286","","90","","90","","120","","1566.33","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","14","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.208 B3.026 Ca0.049 F0.542 Fe0.962 H3.355 K0.008 Li0.649 Mn0.149 Na0.823 O30.458 Si5.871 Ti0.015 Zn0.15 -","- Al7.2084 B3.0258 Ca0.049 F0.542 Fe0.9618 H3.355 K0.008 Li0.6489 Mn0.1491 Na0.823 O30.458 Si5.871 Ti0.015 Zn0.15 -","- Al21.6252 B9.0774 Ca0.147 F1.626 Fe2.8854 H10.065 K0.024 Li1.9467 Mn0.4473 Na2.469 O91.374 Si17.613 Ti0.045 Zn0.45 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: 61Vbh","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003832","15.9569","","15.9569","","7.1369","","90","","90","","120","","1573.76","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","14","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.045 B3 F0.433 Fe1.438 H3.346 K0.007 Li0.299 Mg0.017 Mn0.191 Na0.649 O30.567 Si5.893 Ti0.009 Zn0.108 -","- Al7.0449 B3 F0.433 Fe1.4382 H3.346 K0.007 Li0.2991 Mg0.0171 Mn0.1911 Na0.649 O30.567 Si5.8932 Ti0.009 Zn0.108 -","- Al21.1347 B9 F1.299 Fe4.3146 H10.038 K0.021 Li0.8973 Mg0.0513 Mn0.5733 Na1.947 O91.701 Si17.6796 Ti0.027 Zn0.324 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L4c","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003833","15.9784","","15.9784","","7.1495","","90","","90","","120","","1580.79","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.933 B3 Ca0.036 F0.235 Fe1.908 H3.303 K0.008 Li0.121 Mg0.06 Mn0.098 Na0.602 O30.765 Si5.834 Ti0.027 Zn0.047 -","- Al6.9333 B3 Ca0.036 F0.235 Fe1.9077 H3.303 K0.008 Li0.1209 Mg0.06 Mn0.0981 Na0.602 O30.765 Si5.8338 Ti0.027 Zn0.0471 -","- Al20.7999 B9 Ca0.108 F0.705 Fe5.7231 H9.909 K0.024 Li0.3627 Mg0.18 Mn0.2943 Na1.806 O92.295 Si17.5014 Ti0.081 Zn0.1413 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L3h","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003834","15.9658","","15.9658","","7.1487","","90","","90","","120","","1578.12","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.898 B3 Ca0.009 F0.295 Fe1.774 H3.363 K0.009 Li0.172 Mg0.012 Mn0.124 Na0.632 O30.705 Si5.929 Ti0.023 Zn0.067 -","- Al6.8985 B3 Ca0.009 F0.295 Fe1.7742 H3.363 K0.009 Li0.1719 Mg0.012 Mn0.1239 Na0.632 O30.705 Si5.9292 Ti0.0231 Zn0.0669 -","- Al20.6955 B9 Ca0.027 F0.885 Fe5.3226 H10.089 K0.027 Li0.5157 Mg0.036 Mn0.3717 Na1.896 O92.115 Si17.7876 Ti0.0693 Zn0.2007 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L4b","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003835","15.9768","","15.9768","","7.1534","","90","","90","","120","","1581.33","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","14","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.904 B3 Ca0.022 F0.201 Fe1.982 H3.347 K0.007 Mg0.137 Mn0.043 Na0.556 O30.799 Si5.883 Ti0.019 Zn0.033 -","- Al6.9039 B3 Ca0.022 F0.201 Fe1.9815 H3.347 K0.007 Mg0.1371 Mn0.0429 Na0.556 O30.799 Si5.883 Ti0.0189 Zn0.033 -","- Al20.7117 B9 Ca0.066 F0.603 Fe5.9445 H10.041 K0.021 Mg0.4113 Mn0.1287 Na1.668 O92.397 Si17.649 Ti0.0567 Zn0.099 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L4d","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003836","15.9825","","15.9825","","7.1596","","90","","90","","120","","1583.83","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.757 B3 Ca0.048 F0.201 Fe2.03 H3.367 K0.01 Li0.04 Mg0.251 Mn0.032 Na0.647 O30.799 Si5.831 Ti0.032 Zn0.026 -","- Al6.7569 B3 Ca0.048 F0.201 Fe2.0298 H3.367 K0.01 Li0.0399 Mg0.2508 Mn0.0321 Na0.647 O30.799 Si5.8308 Ti0.0321 Zn0.0261 -","- Al20.2707 B9 Ca0.144 F0.603 Fe6.0894 H10.101 K0.03 Li0.1197 Mg0.7524 Mn0.0963 Na1.941 O92.397 Si17.4924 Ti0.0963 Zn0.0783 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L1v","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9003837","15.9842","","15.9842","","7.1581","","90","","90","","120","","1583.84","","","","","","","","","","","","Cruziero pegmatite, Minas Gerais, Brazil","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.705 B3 Ca0.071 F0.249 Fe2.014 H3.321 K0.007 Li0.05 Mg0.296 Mn0.036 Na0.629 O30.751 Si5.832 Ti0.034 Zn0.031 -","- Al6.7053 B3 Ca0.071 F0.249 Fe2.0145 H3.321 K0.007 Li0.0501 Mg0.2961 Mn0.036 Na0.629 O30.751 Si5.832 Ti0.0339 Zn0.0309 -","- Al20.1159 B9 Ca0.213 F0.747 Fe6.0435 H9.963 K0.021 Li0.1503 Mg0.8883 Mn0.108 Na1.887 O92.253 Si17.496 Ti0.1017 Zn0.0927 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Federico, M.; Graziani, G.; Lucchesi, S.","Crystal chemistry of the elbaite-schorl series Sample: L1z","American Mineralogist","2005","90","","1784","1792","10.2138/am.2005.1827","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9004019","15.8995","","15.8995","","7.1577","","90","","90","","120","","1567.01","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","","- Ag0.18 Al6.981 B3 F0.47 H6.53 Mg2.121 Na0.58 O30.53 Si5.898 -","- Ag0.18 Al6.981 B3 F0.47 H6 Mg2.121 Na0.58 O30.53 Si5.898 -","- Ag0.54 Al20.943 B9 F1.41 H18 Mg6.363 Na1.74 O91.59 Si17.694 -","3","0.166667","","London, D.; Ertl, A.; Hughes, J. M.; Morgan VI G B; Fritz, E. A.; Harms, B. S.","Synthetic Ag-rich tourmaline: Structure and chemistry Note: Y(B) adjusted to satisfy symmetry constraint","American Mineralogist","2006","91","","680","684","10.2138/am.2006.1959","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:32","" "9004078","9.6071","","9.6071","","3.1434","","90","","90","","120","","251.255","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","Millerite","- Ni S -","- Ni S -","- Ni9 S9 -","9","0.5","","Grice, J. D.; Ferguson, R. B.","Crystal structure refinement of millerite (B-NiS)","The Canadian Mineralogist","1974","12","","248","252","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41","" "9004090","15.992","","15.992","","7.19","","90","","90","","120","","1592.45","","","","","","","","","","","","Andreasberg, Harz, Lower Saxony, Germany","13","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.09 B3 Ca0.17 Fe2.43 H4 K0.01 Li0.06 Mg0.12 Mn0.03 Na0.88 O31 Si6 Ti0.06 -","- Al6.09 B3 Ca0.17 Fe2.43 H4 K0.01 Li0.06 Mg0.12 Mn0.03 Na0.88 O31 Si6 Ti0.06 -","- Al18.27 B9 Ca0.51 Fe7.29 H12 K0.03 Li0.18 Mg0.36 Mn0.09 Na2.64 O93 Si18 Ti0.18 -","3","0.166667","","Fortier, S.; Donnay, G.","Schorl refinement showing composition dependence of the tourmaline structure","The Canadian Mineralogist","1975","13","","173","177","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20","" "9004203","16.012","","16.012","","7.245","","90","","90","","120","","1608.65","","","","","","","","","","","","Cuvier Island, New Zealand","10","R 3 m :H","R 3 -2""","160","","","Feruvite","- Al4.722 B3 Ca0.62 Fe1.992 H4 Mg2.025 Na0.38 O31 Si6 Ti0.291 -","- Al4.722 B3 Ca0.62 Fe1.992 H4 Mg2.025 Na0.38 O31 Si6 Ti0.291 -","- Al14.166 B9 Ca1.86 Fe5.976 H12 Mg6.075 Na1.14 O93 Si18 Ti0.873 -","3","0.166667","","Grice, J. D.; Robinson, G. W.","Feruvite, a new member of the tourmaline group, and its crystal structure","The Canadian Mineralogist","1989","27","","199","203","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41","" "9004272","15.932","","15.932","","7.135","","90","","90","","120","","1568.43","","","","","","","","","","","","Nepal","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.26 B3 Ca0.2 F0.66 Fe0.03 H3.34 K0.01 Li1.05 Mn0.81 Na0.67 O30.34 Si5.82 Ti0.03 -","- Al7.26 B3 Ca0.2 F0.66 Fe0.03 H3.34 K0.01 Li1.05 Mn0.81 Na0.67 O30.34 Si5.82 Ti0.03 -","- Al21.78 B9 Ca0.6 F1.98 Fe0.09 H10.02 K0.03 Li3.15 Mn2.43 Na2.01 O91.02 Si17.46 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: NP1","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004273","15.932","","15.932","","7.135","","90","","90","","120","","1568.43","","","","","","","","","","","","Nepal","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.26 B3 Ca0.2 F0.66 Fe0.03 H3.3 K0.01 Li1.05 Mn0.81 Na0.67 O30.3 Si5.82 Ti0.03 -","- Al7.26 B3 Ca0.2 F0.66 Fe0.03 H3.3 K0.01 Li1.05 Mn0.81 Na0.67 O30.3 Si5.82 Ti0.03 -","- Al21.78 B9 Ca0.6 F1.98 Fe0.09 H9.9 K0.03 Li3.15 Mn2.43 Na2.01 O90.9 Si17.46 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: NP1, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004274","15.928","","15.928","","7.137","","90","","90","","120","","1568.08","","","","","","","","","","","","Nepal","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.14 B3 Ca0.16 F0.64 Fe0.15 H3.36 K0.01 Li1.05 Mn0.75 Na0.73 O30.36 Si5.88 Ti0.03 -","- Al7.14 B3 Ca0.16 F0.64 Fe0.15 H3.36 K0.01 Li1.05 Mn0.75 Na0.73 O30.36 Si5.88 Ti0.03 -","- Al21.42 B9 Ca0.48 F1.92 Fe0.45 H10.08 K0.03 Li3.15 Mn2.25 Na2.19 O91.08 Si17.64 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: NP2","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004275","15.928","","15.928","","7.137","","90","","90","","120","","1568.08","","","","","","","","","","","","Nepal","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.14 B3 Ca0.16 F0.66 Fe0.15 H3.36 K0.01 Li1.05 Mn0.75 Na0.73 O30.36 Si5.88 Ti0.03 -","- Al7.14 B3 Ca0.16 F0.66 Fe0.15 H3.36 K0.01 Li1.05 Mn0.75 Na0.73 O30.36 Si5.88 Ti0.03 -","- Al21.42 B9 Ca0.48 F1.98 Fe0.45 H10.08 K0.03 Li3.15 Mn2.25 Na2.19 O91.08 Si17.64 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: NP2, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004276","15.938","","15.938","","7.133","","90","","90","","120","","1569.17","","","","","","","","","","","","Zambia","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al6.96 B3 Ca0.15 F0.56 Fe0.66 H3.44 K0.01 Li0.9 Mn0.48 Na0.69 O30.44 Si5.88 Ti0.12 -","- Al6.96 B3 Ca0.15 F0.56 Fe0.66 H3.44 K0.01 Li0.9 Mn0.48 Na0.69 O30.44 Si5.88 Ti0.12 -","- Al20.88 B9 Ca0.45 F1.68 Fe1.98 H10.32 K0.03 Li2.7 Mn1.44 Na2.07 O91.32 Si17.64 Ti0.36 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: NP3","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004277","15.938","","15.938","","7.133","","90","","90","","120","","1569.17","","","","","","","","","","","","Zambia","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al6.96 B3 Ca0.15 F0.54 Fe0.66 H3.42 K0.01 Li0.9 Mn0.48 Na0.69 O30.42 Si5.88 Ti0.12 -","- Al6.96 B3 Ca0.15 F0.54 Fe0.66 H3.42 K0.01 Li0.9 Mn0.48 Na0.69 O30.42 Si5.88 Ti0.12 -","- Al20.88 B9 Ca0.45 F1.62 Fe1.98 H10.26 K0.03 Li2.7 Mn1.44 Na2.07 O91.26 Si17.64 Ti0.36 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: NP3, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004278","15.872","","15.872","","7.138","","90","","90","","120","","1557.29","","","","","","","","","","","","Zambia","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.11 B3 Ca0.06 F0.65 H3.35 K0.01 Li1.05 Mn0.81 Na0.77 O30.35 Si6 Ti0.03 -","- Al7.11 B3 Ca0.06 F0.65 H3.35 K0.01 Li1.05 Mn0.81 Na0.77 O30.35 Si6 Ti0.03 -","- Al21.33 B9 Ca0.18 F1.95 H10.05 K0.03 Li3.15 Mn2.43 Na2.31 O91.05 Si18 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T10","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:36","" "9004279","15.872","","15.872","","7.138","","90","","90","","120","","1557.29","","","","","","","","","","","","Zambia","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.11 B3 Ca0.06 F0.66 H3.3 K0.01 Li1.05 Mn0.81 Na0.77 O30.3 Si6 Ti0.03 -","- Al7.11 B3 Ca0.06 F0.66 H3.3 K0.01 Li1.05 Mn0.81 Na0.77 O30.3 Si6 Ti0.03 -","- Al21.33 B9 Ca0.18 F1.98 H9.9 K0.03 Li3.15 Mn2.43 Na2.31 O90.9 Si18 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T10, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004280","15.882","","15.882","","7.123","","90","","90","","120","","1555.98","","","","","","","","","","","","Zambia","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.2 B3 Ca0.05 F0.56 H3.44 K0.01 Li0.99 Mn0.84 Na0.74 O30.44 Si5.94 Ti0.03 -","- Al7.2 B3 Ca0.05 F0.56 H3.44 K0.01 Li0.99 Mn0.84 Na0.74 O30.44 Si5.94 Ti0.03 -","- Al21.6 B9 Ca0.15 F1.68 H10.32 K0.03 Li2.97 Mn2.52 Na2.22 O91.32 Si17.82 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T11","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004281","15.882","","15.882","","7.123","","90","","90","","120","","1555.98","","","","","","","","","","","","Zambia","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.2 B3 Ca0.05 F0.54 H3.42 K0.01 Li0.99 Mn0.84 Na0.74 O30.42 Si5.94 Ti0.03 -","- Al7.2 B3 Ca0.05 F0.54 H3.42 K0.01 Li0.99 Mn0.84 Na0.74 O30.42 Si5.94 Ti0.03 -","- Al21.6 B9 Ca0.15 F1.62 H10.26 K0.03 Li2.97 Mn2.52 Na2.22 O91.26 Si17.82 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T11, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004282","15.926","","15.926","","7.106","","90","","90","","120","","1560.88","","","","","","","","","","","","Zambia","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.05 B3 Ca0.04 F0.68 Fe0.06 H3.32 K0.01 Li0.99 Mn0.87 Na0.77 O30.32 Si6 Ti0.03 -","- Al7.05 B3 Ca0.04 F0.68 Fe0.06 H3.32 K0.01 Li0.99 Mn0.87 Na0.77 O30.32 Si6 Ti0.03 -","- Al21.15 B9 Ca0.12 F2.04 Fe0.18 H9.96 K0.03 Li2.97 Mn2.61 Na2.31 O90.96 Si18 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T12","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004283","15.926","","15.926","","7.106","","90","","90","","120","","1560.88","","","","","","","","","","","","Zambia","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.05 B3 Ca0.04 F0.66 Fe0.06 H3.3 K0.01 Li0.99 Mn0.87 Na0.77 O30.3 Si6 Ti0.03 -","- Al7.05 B3 Ca0.04 F0.66 Fe0.06 H3.3 K0.01 Li0.99 Mn0.87 Na0.77 O30.3 Si6 Ti0.03 -","- Al21.15 B9 Ca0.12 F1.98 Fe0.18 H9.9 K0.03 Li2.97 Mn2.61 Na2.31 O90.9 Si18 Ti0.09 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T12, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004284","15.802","","15.802","","7.121","","90","","90","","120","","1539.91","","","","","","","","","","","","Zambia","11","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.32 B3 Ca0.08 F0.67 Fe0.3 H3.33 Li1.23 Mn0.15 Na0.7 O30.33 Si6 -","- Al7.32 B3 Ca0.08 F0.67 Fe0.3 H3.33 Li1.23 Mn0.15 Na0.7 O30.33 Si6 -","- Al21.96 B9 Ca0.24 F2.01 Fe0.9 H9.99 Li3.69 Mn0.45 Na2.1 O90.99 Si18 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T15","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004285","15.802","","15.802","","7.121","","90","","90","","120","","1539.91","","","","","","","","","","","","Zambia","11","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.32 B3 Ca0.08 F0.66 Fe0.3 H3.3 Li1.23 Mn0.15 Na0.7 O30.3 Si6 -","- Al7.32 B3 Ca0.08 F0.66 Fe0.3 H3.3 Li1.23 Mn0.15 Na0.7 O30.3 Si6 -","- Al21.96 B9 Ca0.24 F1.98 Fe0.9 H9.9 Li3.69 Mn0.45 Na2.1 O90.9 Si18 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: T15, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004286","15.854","","15.854","","7.106","","90","","90","","120","","1546.8","","","","","","","","","","","","San Diego mine","10","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.74 B3 Ca0.17 F0.52 H3.48 Li1.35 Mn0.03 Na0.49 O30.48 Si5.88 -","- Al7.74 B3 Ca0.17 F0.52 H3.48 Li1.35 Mn0.03 Na0.49 O30.48 Si5.88 -","- Al23.22 B9 Ca0.51 F1.56 H10.44 Li4.05 Mn0.09 Na1.47 O91.44 Si17.64 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: SD","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004287","15.854","","15.854","","7.106","","90","","90","","120","","1546.8","","","","","","","","","","","","San Diego mine","10","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.74 B3 Ca0.17 F0.48 H3.48 Li1.35 Mn0.03 Na0.49 O30.48 Si5.88 -","- Al7.74 B3 Ca0.17 F0.48 H3.48 Li1.35 Mn0.03 Na0.49 O30.48 Si5.88 -","- Al23.22 B9 Ca0.51 F1.44 H10.44 Li4.05 Mn0.09 Na1.47 O91.44 Si17.64 -","3","0.166667","","Burns, P. C.; MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of manganese-bearing elbaite Sample: SD, split atom model","The Canadian Mineralogist","1994","32","","31","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:37","" "9004362","15.949","","15.949","","7.188","","90","","90","","120","","1583.45","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.514 B3 Ca0.813 Cr0.003 F0.967 H3.033 Li0.024 Mg3.591 Na0.173 O30.033 Si5.814 Ti0.027 V0.027 -","- Al5.514 B3 Ca0.813 Cr0.003 F0.967 H3.033 Li0.024 Mg3.591 Na0.173 O30.033 Si5.814 Ti0.027 V0.027 -","- Al16.542 B9 Ca2.439 Cr0.009 F2.901 H9.099 Li0.072 Mg10.773 Na0.519 O90.099 Si17.442 Ti0.081 V0.081 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T72","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004363","15.95","","15.95","","7.174","","90","","90","","120","","1580.57","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.892 B3 Ca0.762 Cr0.003 F0.832 H3.168 Li0.06 Mg3.327 Na0.229 O30.168 Si5.664 Ti0.027 V0.024 -","- Al5.892 B3 Ca0.762 Cr0.003 F0.832 H3.168 Li0.06 Mg3.327 Na0.229 O30.168 Si5.664 Ti0.027 V0.024 -","- Al17.676 B9 Ca2.286 Cr0.009 F2.496 H9.504 Li0.18 Mg9.981 Na0.687 O90.504 Si16.992 Ti0.081 V0.072 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T73","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004364","15.94","","15.94","","7.177","","90","","90","","120","","1579.25","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.814 B3 Ca0.697 Cr0.006 F0.835 H3.165 Li0.075 Mg3.291 Na0.288 O30.165 Si5.736 Ti0.027 V0.051 -","- Al5.814 B3 Ca0.697 Cr0.006 F0.835 H3.165 Li0.075 Mg3.291 Na0.288 O30.165 Si5.736 Ti0.027 V0.051 -","- Al17.442 B9 Ca2.091 Cr0.018 F2.505 H9.495 Li0.225 Mg9.873 Na0.864 O90.495 Si17.208 Ti0.081 V0.153 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T74","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004365","15.94","","15.94","","7.163","","90","","90","","120","","1576.17","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al6.132 B3 Ca0.768 Cr0.006 F0.737 H3.263 Li0.111 Mg3.108 Na0.205 O30.263 Si5.55 Ti0.033 V0.06 -","- Al6.132 B3 Ca0.768 Cr0.006 F0.737 H3.263 Li0.111 Mg3.108 Na0.205 O30.263 Si5.55 Ti0.033 V0.06 -","- Al18.396 B9 Ca2.304 Cr0.018 F2.211 H9.789 Li0.333 Mg9.324 Na0.615 O90.789 Si16.65 Ti0.099 V0.18 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T75","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004366","15.938","","15.938","","7.179","","90","","90","","120","","1579.29","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.76 B3 Ca0.595 Cr0.009 F0.784 H3.216 Li0.09 Mg3.201 Na0.362 O30.216 Si5.808 Ti0.021 V0.111 -","- Al5.76 B3 Ca0.595 Cr0.009 F0.784 H3.216 Li0.09 Mg3.201 Na0.362 O30.216 Si5.808 Ti0.021 V0.111 -","- Al17.28 B9 Ca1.785 Cr0.027 F2.352 H9.648 Li0.27 Mg9.603 Na1.086 O90.648 Si17.424 Ti0.063 V0.333 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T76","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004367","15.959","","15.959","","7.175","","90","","90","","120","","1582.57","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.916 B3 Ca0.716 Cr0.021 F0.915 H6.085 Li0.057 Mg3.186 Na0.255 O33.085 Si5.586 Ti0.033 V0.201 -","- Al5.916 B3 Ca0.716 Cr0.021 F0.915 H3.085 Li0.057 Mg3.186 Na0.255 O30.085 Si5.586 Ti0.033 V0.201 -","- Al17.748 B9 Ca2.148 Cr0.063 F2.745 H9.255 Li0.171 Mg9.558 Na0.765 O90.255 Si16.758 Ti0.099 V0.603 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T77","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26","" "9004368","15.955","","15.955","","7.17","","90","","90","","120","","1580.68","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al6.084 B3 Ca0.774 Cr0.021 F0.808 H3.192 Li0.078 Mg3.141 Na0.202 O30.192 Si5.514 Ti0.036 V0.126 -","- Al6.084 B3 Ca0.774 Cr0.021 F0.808 H3.192 Li0.078 Mg3.141 Na0.202 O30.192 Si5.514 Ti0.036 V0.126 -","- Al18.252 B9 Ca2.322 Cr0.063 F2.424 H9.576 Li0.234 Mg9.423 Na0.606 O90.576 Si16.542 Ti0.108 V0.378 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T78","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004369","15.958","","15.958","","7.18","","90","","90","","120","","1583.48","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.862 B3 Ca0.769 Cr0.009 F0.805 H3.195 Li0.054 Mg3.288 Na0.202 O30.195 Si5.628 Ti0.036 V0.123 -","- Al5.862 B3 Ca0.769 Cr0.009 F0.805 H3.195 Li0.054 Mg3.288 Na0.202 O30.195 Si5.628 Ti0.036 V0.123 -","- Al17.586 B9 Ca2.307 Cr0.027 F2.415 H9.585 Li0.162 Mg9.864 Na0.606 O90.585 Si16.884 Ti0.108 V0.369 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T79","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004370","15.957","","15.957","","7.175","","90","","90","","120","","1582.18","","","","","","","","","","","","East Africa","13","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.916 B3 Ca0.746 Cr0.015 F0.854 H3.146 Li0.066 Mg3.21 Na0.221 O30.146 Si5.604 Ti0.027 V0.162 -","- Al5.916 B3 Ca0.746 Cr0.015 F0.854 H3.146 Li0.066 Mg3.21 Na0.221 O30.146 Si5.604 Ti0.027 V0.162 -","- Al17.748 B9 Ca2.238 Cr0.045 F2.562 H9.438 Li0.198 Mg9.63 Na0.663 O90.438 Si16.812 Ti0.081 V0.486 -","3","0.166667","","MacDonald, D. J.; Hawthorne, F. C.","The crystal chemistry of Si=Al substitution in tourmaline Sample: T80","The Canadian Mineralogist","1995","33","","849","858","","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004401","15.917","","15.917","","7.189","","90","","90","","120","","1577.33","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Uvite","- Al6.45 B3 Ca0.43 Cr0.06 H3 Mg2.49 Na0.4 O31 Si6 -","- Al6.45 B3 Ca0.43 Cr0.06 H3 Mg2.49 Na0.4 O31 Si6 -","- Al19.35 B9 Ca1.29 Cr0.18 H9 Mg7.47 Na1.2 O93 Si18 -","3","0.166667","","Taylor, M. C.; Cooper, M. A.; Hawthorne, F. C.","Local charge-compensation in hydroxyl-deficient uvite","The Canadian Mineralogist","1995","33","","1215","1221","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41","" "9004448","7.225","","7.225","","17.03","","90","","90","","120","","769.876","","","","","","","","","","","","Tsumeb, Namibia","6","R 3 m :H","R 3 -2""","160","","","Gallobeudantite","- As Ga3 H9 O17 Pb6 S -","- As Ga3 H6 O14 Pb6 S -","- As3 Ga9 H18 O42 Pb18 S3 -","3","0.166667","","Jambor, J. L.; Owens, D. R.; Grice, J. D.; Feinglos, M. N.","Gallobeudantite, PbGa3[(AsO4),(SO4)]2(OH)6, a new mineral species from Tsumeb, Namibia, and associated new gallium analogues of the alunite - jarosite family Locality: Tsumeb, Namibia","The Canadian Mineralogist","1996","34","","1305","1315","","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26","" "9004519","7.0179","","7.0179","","40.56","","90","","90","","120","","1729.99","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","Nacaphite","- Ca5 F5 Na10 O20 P5 -","- Ca4.99995 F5 Na10 O20 P5 -","- Ca14.9998 F15 Na30.0001 O60 P15 -","3","0.166667","","Sokolova, E. V.; Kabalov, Y. K.; Ferraris, G.; Schneider, J.; Khomyakov, A. P.","Modular approach in solving the crystal structure of a synthetic dimorph of nacaphite, Na2Ca[PO4]F, from powder-diffraction data","The Canadian Mineralogist","1999","37","","83","90","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41","" "9004541","15.973","","15.973","","7.137","","90","","90","","120","","1576.95","","","","","","","","","","","","","11","R 3 m :H","R 3 -2""","160","","","Foitite","- Al6.99 B2.88 Ca0.002 F0.11 Fe1.71 H4 K0.002 Mg0.3 Na0.414 O30.89 Si6 -","- Al6.99 B2.88 Ca0.002 F0.11 Fe1.71 H3.54 K0.002 Mg0.3 Na0.414 O30.89 Si6 -","- Al20.97 B8.64 Ca0.006 F0.33 Fe5.13 H10.62 K0.006 Mg0.9 Na1.242 O92.67 Si18 -","3","0.166667","","Francis C A; Dyar M D; Williams M L; Hughes J M","The occurrence and crystal structure of foitite from a tungsten-bearing vein at Copper Mountain, Taos County, New Mexico Note: y-coordinate of H3 changed to x/2. Locality: Copper Mountain, Taos County, New Mexico","The Canadian Mineralogist","1999","37","","1431","1438","","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:54:09","" "9004600","15.731","","15.731","","7.0638","","90","","90","","120","","1513.85","","","","","","","","","","","","Stoffhutte, Koralpe, Austria","9","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.424 B4.062 Ca0.4 F0.06 H3.31 Li0.357 Na0.294 O30.94 Si4.854 -","- Al8.424 B4.062 Ca0.4 F0.06 H3.31 Li0.357 Na0.294 O30.94 Si4.854 -","- Al25.272 B12.186 Ca1.2 F0.18 H9.93 Li1.071 Na0.882 O92.82 Si14.562 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Shearer, C. K.; Yates, M. G.; Guidotti, C. V.","Tetrahedrally coordinated boron in a tourmaline: Boron-rich olenite from Stoffhutte, Koralpe, Austria","The Canadian Mineralogist","2000","38","","861","868","10.2113/gscanmin.38.4.861","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:20","" "9004799","15.9238","","15.9238","","7.1822","","90","","90","","120","","1577.18","","","","","","","","","","","","Goslarn, Austria","12","R 3 m :H","R 3 -2""","160","","","Olenite","- Al6.405 B3 Ca0.1 F0.03 Fe0.39 H3.05 K0.001 Mg2.163 Na0.71 O30.97 Si5.952 Ti0.09 -","- Al6.405 B3 Ca0.1 F0.03 Fe0.39 H3.05 K0.001 Mg2.163 Na0.71 O30.97 Si5.952 Ti0.09 -","- Al19.215 B9 Ca0.3 F0.09 Fe1.17 H9.15 K0.003 Mg6.489 Na2.13 O92.91 Si17.856 Ti0.27 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Brandstatter, F.; Dyar, M. D.; Prasad, P. S. R.","Disordered Mg-bearing olenite from a granitic pegmatite at Goslarn, Austria: A chemical, structural, and infrared spectroscopic study Sample: GOS1, from the sample rim","The Canadian Mineralogist","2003","41","","1363","1370","10.2113/gscanmin.41.6.1363","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004800","15.9149","","15.9149","","7.1757","","90","","90","","120","","1573.99","","","","","","","","","","","","Goslarn, Austria","12","R 3 m :H","R 3 -2""","160","","","Olenite","- Al6.483 B3 Ca0.11 F0.03 Fe0.411 H3.07 K0.002 Mg2.007 Na0.64 O30.97 Si6 Ti0.099 -","- Al6.483 B3 Ca0.11 F0.03 Fe0.411 H3.07 K0.002 Mg2.007 Na0.64 O30.97 Si6 Ti0.099 -","- Al19.449 B9 Ca0.33 F0.09 Fe1.233 H9.21 K0.006 Mg6.021 Na1.92 O92.91 Si18 Ti0.297 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Brandstatter, F.; Dyar, M. D.; Prasad, P. S. R.","Disordered Mg-bearing olenite from a granitic pegmatite at Goslarn, Austria: A chemical, structural, and infrared spectroscopic study Sample: GOS2, from the sample core","The Canadian Mineralogist","2003","41","","1363","1370","10.2113/gscanmin.41.6.1363","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9004880","15.938","","15.938","","7.136","","90","","90","","120","","1569.83","","","","","","","","","","","","Eibenstein, Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.656 B3 Ca0.01 F0.14 Fe0.93 H1.92 Li0.048 Mg0.132 Mn0.42 Na0.52 O30.86 Si5.73 Ti0.03 -","- Al7.656 B3 Ca0.01 F0.14 Fe0.93 H1.92 Li0.048 Mg0.132 Mn0.42 Na0.52 O30.86 Si5.73 Ti0.03 -","- Al22.968 B9 Ca0.03 F0.42 Fe2.79 H5.76 Li0.144 Mg0.396 Mn1.26 Na1.56 O92.58 Si17.19 Ti0.09 -","3","0.166667","","Ertl, A.; Pertlik, F.; Dyar, M. D.; Prowatke, S.; Hughes, J. M.; Ludwig, T.; Bernhardt, H. J.","Fe-rich olenite with tetrahedrally coordinated Fe3+ from Eibenstein, Austria: Structural, chemical, and Mossbauer data Locality: Eibenstein, Austria","The Canadian Mineralogist","2004","42","","1057","1063","10.2113/gscanmin.42.4.1057","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42","" "9004970","15.8838","","15.8838","","7.1056","","90","","90","","120","","1552.53","","","","","","","","","","","","Kutna Hora, Czech Republic","12","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.46 B3 Ca0.14 F0.01 Fe0.78 H2.49 K0.01 Mg0.12 Mn0.06 Na0.54 O31 Si5.58 -","- Al8.46 B3 Ca0.14 F0.01 Fe0.78 H1.245 K0.01 Mg0.12 Mn0.06 Na0.54 O30.99 Si5.58 -","- Al25.38 B9 Ca0.42 F0.03 Fe2.34 H3.735 K0.03 Mg0.36 Mn0.18 Na1.62 O92.97 Si16.74 -","3","0.166667","","Cempirek, J.; Novak, M.; Ertl, A.; Hughes, J. M.; Rossman, G. R.; Dyar, D.","Fe-bearing olenite with tetrahedrally coordinated Al from an abyssal pegmatite at Kutna Hora, Czech Republic: structure, crystal chemistry, optical and xanes spectra","The Canadian Mineralogist","2006","44","","23","60","10.2113/gscanmin.44.1.23","","","","","","","","","","","","","","","","","","","","","has coordinates","285044","2023-07-06","18:10:13","" "9004972","14.2675","","14.2675","","30.0369","","90","","90","","120","","5295.19","","","","","","","","","","","","Poudrette Quarry, Mont Saint-Hilaire, Rouville County, Quebec, Canada","22","R 3 m :H","R 3 -2""","160","","","Johnsenite-(Ce)","- C H0.5 Ca5.67 Ce0.69 Cl1.5 Dy0.03 Fe0.81 Gd0.06 K0.15 La0.36 Mn2.55 Na11.85 Nb0.16 Nd0.18 O81.38 Pr0.24 Si24.96 Sr0.51 Ti0.3 W0.82 Y0.24 Zr2.7 -","- C Ca5.67 Ce0.69 Cl1.5 Dy0.03 Fe0.81 Gd0.06 K0.15 La0.36 Mn2.55 Na11.85 Nb0.16 Nd0.18 O81.38 Pr0.24 Si24.96 Sr0.51 Ti0.3 W0.82 Y0.24 Zr2.7 -","- C3 Ca17.01 Ce2.07 Cl4.5 Dy0.09 Fe2.43 Gd0.18 K0.45 La1.08 Mn7.65 Na35.55 Nb0.48 Nd0.54 O244.14 Pr0.72 Si74.88 Sr1.53 Ti0.9 W2.46 Y0.72 Zr8.1 -","3","0.166667","","Grice, J. C.; Gault, R. A.","Johnsenite-(Ce): A new member of the eudialyte group from Mont Saint-Hilaire, Quebec, Canada Locality: Poudrette Quarry, Mont Saint-Hilaire, Rouville County, Quebec, Canada Note: Occupancies invented to satisfy constraints from paper","The Canadian Mineralogist","2006","44","","105","115","10.2113/gscanmin.44.1.105","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:21","" "9005328","14.1686","","14.1686","","30.0847","","90","","90","","120","","5230.34","","","","","","","","","","","","Kangerdlugssuaq intrusion, East Greenland","18","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Al0.13 Ca3.27 Cl0.269 F1.51 Fe0.79 H0.22 Hf0.06 K0.3 Mg0.05 Mn3.68 Na14.479 Nb0.55 O75.81 Si25.1 Sr0.15 Ti0.23 Y0.42 Zr2.93 -","- Al0.1299 Ca3.27 Cl0.2695 F1.5103 Fe0.7899 Hf0.06 K0.3 Mg0.0501 Mn3.6801 Na14.4795 Nb0.55 O75.8101 Si25.1 Sr0.15 Ti0.2299 Y0.42 Zr2.9301 -","- Al0.3897 Ca9.81 Cl0.8085 F4.5309 Fe2.3697 Hf0.18 K0.9 Mg0.1503 Mn11.0403 Na43.4385 Nb1.65 O227.43 Si75.3 Sr0.45 Ti0.6897 Y1.26 Zr8.7903 -","3","0.166667","","Johnsen, O.; Grice, J. D.; Gault, R. A.","Kentbrooksite from the Kangerdlugssuaq intrusion, East Greenland, a new Mn-REE-Nb-F end-member in a series within the eudialyte group: Description and crystal structure","European Journal of Mineralogy","1998","10","","207","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42","" "9005381","15.88","","15.88","","7.118","","90","","90","","120","","1554.5","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.483 H3.93 K0.105 Li2 Na0.412 O33 Si6 -","- Al6.99999 B3 Ca0.483 H3.99999 K0.105 Li2.00001 Na0.412 O33 Si6 -","- Al21 B9 Ca1.449 H12 K0.315 Li6.00003 Na1.236 O99 Si18 -","3","0.166667","","Aurisicchio C; Demartin F; Ottolini L; Pezzotta F","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 1 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33","" "9005382","15.882","","15.882","","7.115","","90","","90","","120","","1554.23","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.452 H3.93 K0.04 Li2 Na0.435 O33 Si6 -","- Al6.99999 B3 Ca0.452 H3.99999 K0.04 Li2.00001 Na0.435 O33 Si6 -","- Al21 B9 Ca1.356 H12 K0.12 Li6.00003 Na1.305 O99 Si18 -","3","0.166667","","Aurisicchio C; Demartin F; Ottolini L; Pezzotta F","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 2 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:33","" "9005457","15.964","","15.964","","7.119","","90","","90","","120","","1571.21","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Foitite","- Al7.419 B3 Fe1.581 H3.58 O31 Si6 -","- Al7.419 B3 Fe1.581 H3.58 O31 Si6 -","- Al22.257 B9 Fe4.743 H10.74 O93 Si18 -","3","0.166667","","Kahlenberg, V.; Velickov, B.","Structural investigations on a synthetic alkali-free hydrogen-deficient Fe-tourmaline (foitite)","European Journal of Mineralogy","2000","12","","947","953","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:52:53","" "9005554","15.5996","","15.5996","","7.0224","","90","","90","","120","","1479.94","","","","","","","","","","","","","5","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.88 B5.22 Na0.77 O31 Si3.78 -","- Al8.88 B5.22 Na0.77 O31.52 Si3.78 -","- Al26.64 B15.66 Na2.31 O94.56 Si11.34 -","3","0.166667","","Marler, B.; Borowski, M.; Wodara, U.; Schreyer, W.","Synthetic tourmaline (olenite) with excess boron replacing silicon in the tetrahedral site: II. Structure analysis Sample: 1","European Journal of Mineralogy","2002","14","","763","771","10.1127/0935-1221/2002/0014-0763","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42","" "9005555","15.6329","","15.6329","","7.0365","","90","","90","","120","","1489.25","","","","","","","","","","","","Synthetic","5","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.88 B4.8 Na0.67 O31 Si4.2 -","- Al8.88 B4.8 Na0.67 O31.52 Si4.2 -","- Al26.64 B14.4 Na2.01 O94.56 Si12.6 -","3","0.166667","","Marler, B.; Borowski, M.; Wodara, U.; Schreyer, W.","Synthetic tourmaline (olenite) with excess boron replacing silicon in the tetrahedral site: II. Structure analysis Sample: 2","European Journal of Mineralogy","2002","14","","763","771","10.1127/0935-1221/2002/0014-0763","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42","" "9005561","15.792","","15.792","","7.0878","","90","","90","","120","","1530.79","","","","","","","","","","","","","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.469 B3.438 H3 Na0.58 O31 Si5.562 -","- Al8.469 B3.438 H3 Na0.58 O31 Si5.562 -","- Al25.407 B10.314 H9 Na1.74 O93 Si16.686 -","3","0.166667","","Schreyer, W.; Hughes, J. M.; Bernhardt, H. J.; Kalt, A.; Prowatke, S.; Ertl, A.","Reexamination of olenite from the type locality: detection of boron in tetrahedral coordination Note: z-coordinate for AlY and y-coordinate for H were altered by Hughes, Aug 2003","European Journal of Mineralogy","2002","14","","935","942","10.1127/0935-1221/2002/0014-0935","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:08","" "9005647","15.961","","15.961","","7.2214","","90","","90","","120","","1593.21","","","","","","","","","","","","Olkhon (Lake Baikal), Siberia","13","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al5.37 B3 Ca0.246 Cr0.3 F0.081 H0.536 K0.012 Mg2.55 Na0.457 O30.919 Si5.952 Ti0.024 V0.804 -","- Al5.37 B3 Ca0.246 Cr0.3 F0.081 H0.536 K0.012 Mg2.55 Na0.457 O30.919 Si5.952 Ti0.024 V0.804 -","- Al16.11 B9 Ca0.738 Cr0.9 F0.243 H1.608 K0.036 Mg7.65 Na1.371 O92.757 Si17.856 Ti0.072 V2.412 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline sample TM507c","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005648","15.9521","","15.9521","","7.2167","","90","","90","","120","","1590.4","","","","","","","","","","","","Olkhon (Lake Baikal), Siberia","14","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al5.628 B3 Ca0.335 Cr0.159 F0.054 Fe0.003 H0.507 K0.01 Mg2.715 Na0.479 O30.946 Si5.952 Ti0.039 V0.504 -","- Al5.628 B3 Ca0.335 Cr0.159 F0.054 Fe0.003 H0.507 K0.01 Mg2.715 Na0.479 O30.946 Si5.952 Ti0.039 V0.504 -","- Al16.884 B9 Ca1.005 Cr0.477 F0.162 Fe0.009 H1.521 K0.03 Mg8.145 Na1.437 O92.838 Si17.856 Ti0.117 V1.512 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM507e","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005649","15.9433","","15.9433","","7.2095","","90","","90","","120","","1587.06","","","","","","","","","","","","Beresov Mine, Siberia","15","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al6.228 B3 Ca0.077 F0.004 Fe0.6 H0.632 K0.004 Mg2.085 Mn0.003 Na0.751 O30.996 Si5.988 Ti0.084 V0.003 Zn0.009 -","- Al6.228 B3 Ca0.077 F0.004 Fe0.6 H0.632 K0.004 Mg2.085 Mn0.003 Na0.751 O30.996 Si5.988 Ti0.084 V0.003 Zn0.009 -","- Al18.684 B9 Ca0.231 F0.012 Fe1.8 H1.896 K0.012 Mg6.255 Mn0.009 Na2.253 O92.988 Si17.964 Ti0.252 V0.009 Zn0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM235a","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005650","15.9388","","15.9388","","7.205","","90","","90","","120","","1585.17","","","","","","","","","","","","Beresov Mine, Siberia","15","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al6.303 B3 Ca0.094 Cr0.003 F0.046 Fe0.576 H0.572 K0.003 Mg2.064 Na0.724 O30.954 Si5.982 Ti0.063 V0.003 Zn0.012 -","- Al6.303 B3 Ca0.094 Cr0.003 F0.046 Fe0.576 H0.572 K0.003 Mg2.064 Na0.724 O30.954 Si5.982 Ti0.063 V0.003 Zn0.012 -","- Al18.909 B9 Ca0.282 Cr0.009 F0.138 Fe1.728 H1.716 K0.009 Mg6.192 Na2.172 O92.862 Si17.946 Ti0.189 V0.009 Zn0.036 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM235b","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005651","15.9633","","15.9633","","7.1942","","90","","90","","120","","1587.66","","","","","","","","","","","","Haddam, Connecticut, U.S.A.","16","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al6.198 B3 Ca0.257 Cr0.009 F0.126 Fe0.834 H0.47 K0.002 Mg2.013 Mn0.003 Na0.558 O30.874 Si5.856 Ti0.054 V0.009 Zn0.009 -","- Al6.198 B3 Ca0.257 Cr0.009 F0.126 Fe0.834 H0.47 K0.002 Mg2.013 Mn0.003 Na0.558 O30.874 Si5.856 Ti0.054 V0.009 Zn0.009 -","- Al18.594 B9 Ca0.771 Cr0.027 F0.378 Fe2.502 H1.41 K0.006 Mg6.039 Mn0.009 Na1.674 O92.622 Si17.568 Ti0.162 V0.027 Zn0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM112a","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005652","15.9636","","15.9636","","7.1911","","90","","90","","120","","1587.04","","","","","","","","","","","","Haddam, Connecticut, U.S.A.","15","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al6.198 B3 Ca0.263 Cr0.015 F0.06 Fe0.801 H0.469 K0.003 Mg2.034 Mn0.009 Na0.559 O30.94 Si5.88 Ti0.06 V0.009 -","- Al6.198 B3 Ca0.263 Cr0.015 F0.06 Fe0.801 H0.469 K0.003 Mg2.034 Mn0.009 Na0.559 O30.94 Si5.88 Ti0.06 V0.009 -","- Al18.594 B9 Ca0.789 Cr0.045 F0.18 Fe2.403 H1.407 K0.009 Mg6.102 Mn0.027 Na1.677 O92.82 Si17.64 Ti0.18 V0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM112c","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005653","15.9355","","15.9355","","7.2002","","90","","90","","120","","1583.46","","","","","","","","","","","","Zillerthal, Tyrol, Austria","14","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al6.387 B3 Ca0.099 F0.004 Fe0.486 H0.633 K0.004 Mg2.151 Na0.714 O30.995 Si5.922 Ti0.039 V0.003 Zn0.012 -","- Al6.387 B3 Ca0.099 F0.004 Fe0.486 H0.633 K0.004 Mg2.151 Na0.714 O30.995 Si5.922 Ti0.039 V0.003 Zn0.012 -","- Al19.161 B9 Ca0.297 F0.012 Fe1.458 H1.899 K0.012 Mg6.453 Na2.142 O92.985 Si17.766 Ti0.117 V0.009 Zn0.036 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM233g","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005654","15.9267","","15.9267","","7.1991","","90","","90","","120","","1581.47","","","","","","","","","","","","Kwale, Mombasa, Kenya","16","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al6.213 B3 Ca0.007 Cr0.006 F0.021 Fe0.54 H0.405 K0.011 Mg2.208 Mn0.003 Na0.742 O30.978 Si6 Ti0.021 V0.003 Zn0.003 -","- Al6.213 B3 Ca0.007 Cr0.006 F0.021 Fe0.54 H0.405 K0.011 Mg2.208 Mn0.003 Na0.742 O30.978 Si6 Ti0.021 V0.003 Zn0.003 -","- Al18.639 B9 Ca0.021 Cr0.018 F0.063 Fe1.62 H1.215 K0.033 Mg6.624 Mn0.009 Na2.226 O92.934 Si18 Ti0.063 V0.009 Zn0.009 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM501e","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005655","15.9391","","15.9391","","7.1515","","90","","90","","120","","1573.46","","","","","","","","","","","","Cooma, New South Wales, Australia","15","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.981 B3 Ca0.01 F0.038 Fe1.365 H0.395 K0.006 Mg0.612 Mn0.054 Na0.451 O30.963 Si5.952 Ti0.027 V0.003 Zn0.012 -","- Al6.981 B3 Ca0.01 F0.038 Fe1.365 H0.395 K0.006 Mg0.612 Mn0.054 Na0.451 O30.963 Si5.952 Ti0.027 V0.003 Zn0.012 -","- Al20.943 B9 Ca0.03 F0.114 Fe4.095 H1.185 K0.018 Mg1.836 Mn0.162 Na1.353 O92.889 Si17.856 Ti0.081 V0.009 Zn0.036 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM84a","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005656","15.9856","","15.9856","","7.184","","90","","90","","120","","1589.84","","","","","","","","","","","","Bovey Tracy, Devonshire, England","14","R 3 m :H","R 3 -2""","160","","","Hydroxy-schorl","- Al6.3 B3 Ca0.093 F0.205 Fe1.734 H0.443 K0.009 Mg0.975 Mn0.012 Na0.682 O30.795 Si5.874 Ti0.081 Zn0.015 -","- Al6.3 B3 Ca0.093 F0.205 Fe1.734 H0.443 K0.009 Mg0.975 Mn0.012 Na0.682 O30.795 Si5.874 Ti0.081 Zn0.015 -","- Al18.9 B9 Ca0.279 F0.615 Fe5.202 H1.329 K0.027 Mg2.925 Mn0.036 Na2.046 O92.385 Si17.622 Ti0.243 Zn0.045 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: TourmalineTM60e","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005657","15.9541","","15.9541","","7.2035","","90","","90","","120","","1587.88","","","","","","","","","","","","Arendal, Norway","15","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al6.111 B3 Ca0.11 F0.02 Fe0.783 H0.618 K0.01 Mg2.088 Mn0.006 Na0.677 O30.98 Si5.958 Ti0.042 V0.006 Zn0.009 -","- Al6.111 B3 Ca0.11 F0.02 Fe0.783 H0.618 K0.01 Mg2.088 Mn0.006 Na0.677 O30.98 Si5.958 Ti0.042 V0.006 Zn0.009 -","- Al18.333 B9 Ca0.33 F0.06 Fe2.349 H1.854 K0.03 Mg6.264 Mn0.018 Na2.031 O92.94 Si17.874 Ti0.126 V0.018 Zn0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM65e","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005658","15.9706","","15.9706","","7.2276","","90","","90","","120","","1596.49","","","","","","","","","","","","Olkhon (Lake Baikal), Siberia","16","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al5.262 B3 Ca0.412 Cr0.168 F0.314 Fe0.006 H0.248 K0.015 Mg2.784 Mn0.003 Na0.477 O30.685 Si5.91 Ti0.027 V0.831 Zn0.015 -","- Al5.262 B3 Ca0.412 Cr0.168 F0.314 Fe0.006 H0.248 K0.015 Mg2.784 Mn0.003 Na0.477 O30.685 Si5.91 Ti0.027 V0.831 Zn0.015 -","- Al15.786 B9 Ca1.236 Cr0.504 F0.942 Fe0.018 H0.744 K0.045 Mg8.352 Mn0.009 Na1.431 O92.055 Si17.73 Ti0.081 V2.493 Zn0.045 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM504c","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005659","15.9659","","15.9659","","7.1693","","90","","90","","120","","1582.68","","","","","","","","","","","","Cruziero, Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Hydroxy-schorl","- Al6.675 B3 F0.177 Fe1.668 H0.512 K0.013 Li0.012 Mg0.663 Na0.633 O30.823 Si5.91 Ti0.051 Zn0.009 -","- Al6.675 B3 F0.177 Fe1.668 H0.512 K0.013 Li0.012 Mg0.663 Na0.633 O30.823 Si5.91 Ti0.051 Zn0.009 -","- Al20.025 B9 F0.531 Fe5.004 H1.536 K0.039 Li0.036 Mg1.989 Na1.899 O92.469 Si17.73 Ti0.153 Zn0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TMl2ap","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:50","" "9005660","15.9736","","15.9736","","7.1644","","90","","90","","120","","1583.13","","","","","","","","","","","","Cruziero, Minas Gerais, Brazil","14","R 3 m :H","R 3 -2""","160","","","Hydroxy-schorl","- Al6.798 B3 F0.178 Fe1.725 H0.538 K0.013 Li0.024 Mg0.498 Mn0.048 Na0.678 O30.821 Si5.838 Ti0.03 Zn0.039 -","- Al6.798 B3 F0.178 Fe1.725 H0.538 K0.013 Li0.024 Mg0.498 Mn0.048 Na0.678 O30.821 Si5.838 Ti0.03 Zn0.039 -","- Al20.394 B9 F0.534 Fe5.175 H1.614 K0.039 Li0.072 Mg1.494 Mn0.144 Na2.034 O92.463 Si17.514 Ti0.09 Zn0.117 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TMl2al","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005661","15.9669","","15.9669","","7.1745","","90","","90","","120","","1584.03","","","","","","","","","","","","Cruziero, Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.39 B3 F0.207 Fe1.665 K0.006 Li0.006 Mg0.906 Mn0.024 Na0.727 O30.793 Si5.94 Ti0.048 Zn0.018 -","- Al6.39 B3 F0.207 Fe1.665 K0.006 Li0.006 Mg0.906 Mn0.024 Na0.727 O30.793 Si5.94 Ti0.048 Zn0.018 -","- Al19.17 B9 F0.621 Fe4.995 K0.018 Li0.018 Mg2.718 Mn0.072 Na2.181 O92.379 Si17.82 Ti0.144 Zn0.054 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TMl3l","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005662","15.9664","","15.9664","","7.1758","","90","","90","","120","","1584.22","","","","","","","","","","","","Cruziero, Minas Gerais, Brazil","14","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.429 B3 F0.157 Fe1.617 H0.14 K0.009 Li0.012 Mg0.879 Mn0.027 Na0.712 O30.843 Si5.964 Ti0.051 Zn0.024 -","- Al6.429 B3 F0.157 Fe1.617 H0.14 K0.009 Li0.012 Mg0.879 Mn0.027 Na0.712 O30.843 Si5.964 Ti0.051 Zn0.024 -","- Al19.287 B9 F0.471 Fe4.851 H0.42 K0.027 Li0.036 Mg2.637 Mn0.081 Na2.136 O92.529 Si17.892 Ti0.153 Zn0.072 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TMl4aa","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005663","15.9341","","15.9341","","7.189","","90","","90","","120","","1580.72","","","","","","","","","","","","Lake Baikal, Siberia","16","R 3 m :H","R 3 -2""","160","","","Hydroxy-dravite","- Al6.339 B3 Ca0.151 Cr0.003 F0.07 Fe0.348 H0.51 K0.01 Mg2.184 Mn0.012 Na0.605 O30.93 Si5.94 Ti0.129 V0.024 Zn0.021 -","- Al6.339 B3 Ca0.151 Cr0.003 F0.07 Fe0.348 H0.51 K0.01 Mg2.184 Mn0.012 Na0.605 O30.93 Si5.94 Ti0.129 V0.024 Zn0.021 -","- Al19.017 B9 Ca0.453 Cr0.009 F0.21 Fe1.044 H1.53 K0.03 Mg6.552 Mn0.036 Na1.815 O92.79 Si17.82 Ti0.387 V0.072 Zn0.063 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM9840c","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005664","15.9303","","15.9303","","7.1951","","90","","90","","120","","1581.3","","","","","","","","","","","","Lake Baikal, Siberia","16","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al6.291 B3 Ca0.187 Cr0.006 F0.054 Fe0.342 H0.442 K0.013 Mg2.214 Mn0.012 Na0.594 O30.946 Si5.952 Ti0.144 V0.039 Zn0.006 -","- Al6.291 B3 Ca0.187 Cr0.006 F0.054 Fe0.342 H0.442 K0.013 Mg2.214 Mn0.012 Na0.594 O30.946 Si5.952 Ti0.144 V0.039 Zn0.006 -","- Al18.873 B9 Ca0.561 Cr0.018 F0.162 Fe1.026 H1.326 K0.039 Mg6.642 Mn0.036 Na1.782 O92.838 Si17.856 Ti0.432 V0.117 Zn0.018 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM9840f","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005665","15.9821","","15.9821","","7.2215","","90","","90","","120","","1597.44","","","","","","","","","","","","Lake Baikal, Siberia","16","R 3 m :H","R 3 -2""","160","","","Hydroxy-schorl","- Al5.805 B3 Ca0.163 Cr0.003 F0.042 Fe1.404 H0.509 K0.005 Mg1.728 Mn0.003 Na0.731 O30.958 Si5.91 Ti0.09 V0.045 Zn0.009 -","- Al5.805 B3 Ca0.163 Cr0.003 F0.042 Fe1.404 H0.509 K0.005 Mg1.728 Mn0.003 Na0.731 O30.958 Si5.91 Ti0.09 V0.045 Zn0.009 -","- Al17.415 B9 Ca0.489 Cr0.009 F0.126 Fe4.212 H1.527 K0.015 Mg5.184 Mn0.009 Na2.193 O92.874 Si17.73 Ti0.27 V0.135 Zn0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.","Crystal chemistry of the schorl-dravite series Note: Tourmaline TM9914b","European Journal of Mineralogy","2004","16","","335","344","10.1127/0935-1221/2004/0016-0335","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005666","16.0539","","16.0539","","7.3247","","90","","90","","120","","1634.86","","","","","","","","","","","","Sludyanka crystalline complex, Lake Baikal, Russia","15","R 3 m :H","R 3 -2""","160","","","Chromdravite","- Al2.1 B3 Ca0.073 Cr4.347 F0.381 Fe0.051 H3.009 K0.017 Mg2.244 Na0.88 O30.618 Si5.886 Ti0.003 V0.354 Zn0.021 -","- Al2.1 B3 Ca0.073 Cr4.347 F0.381 Fe0.051 H3.009 K0.017 Mg2.244 Na0.88 O30.618 Si5.886 Ti0.003 V0.354 Zn0.021 -","- Al6.3 B9 Ca0.219 Cr13.041 F1.143 Fe0.153 H9.027 K0.051 Mg6.732 Na2.64 O91.854 Si17.658 Ti0.009 V1.062 Zn0.063 -","3","0.166667","","Bosi, F.; Lucchesi, S.; Reznitskii, L.","Crystal chemistry of the dravite-chromdravite series Note: Tourmaline TMt3b","European Journal of Mineralogy","2004","16","","345","352","10.1127/0935-1221/2004/0016-0345","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005667","16.0377","","16.0377","","7.3157","","90","","90","","120","","1629.56","","","","","","","","","","","","Sludyanka crystalline complex, Lake Baikal, Russia","14","R 3 m :H","R 3 -2""","160","","","Chromdravite","- Al2.364 B3 Ca0.068 Cr4.029 F0.332 Fe0.036 H2.982 K0.017 Mg2.322 Na0.892 O30.668 Si5.976 Ti0.03 V0.243 -","- Al2.364 B3 Ca0.068 Cr4.029 F0.332 Fe0.036 H2.982 K0.017 Mg2.322 Na0.892 O30.668 Si5.976 Ti0.03 V0.243 -","- Al7.092 B9 Ca0.204 Cr12.087 F0.996 Fe0.108 H8.946 K0.051 Mg6.966 Na2.676 O92.004 Si17.928 Ti0.09 V0.729 -","3","0.166667","","Bosi, F.; Lucchesi, S.; Reznitskii, L.","Crystal chemistry of the dravite-chromdravite series Note: Tourmaline TMt6b","European Journal of Mineralogy","2004","16","","345","352","10.1127/0935-1221/2004/0016-0345","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005668","16.0299","","16.0299","","7.3056","","90","","90","","120","","1625.73","","","","","","","","","","","","Sludyanka crystalline complex, Lake Baikal, Russia","15","R 3 m :H","R 3 -2""","160","","","Chromdravite","- Al2.856 B3 Ca0.043 Cr3.372 F0.361 Fe0.027 H2.937 K0.027 Mg2.085 Na0.842 O30.639 Si5.868 Ti0.003 V0.783 Zn0.009 -","- Al2.856 B3 Ca0.043 Cr3.372 F0.361 Fe0.027 H2.937 K0.027 Mg2.085 Na0.842 O30.639 Si5.868 Ti0.003 V0.783 Zn0.009 -","- Al8.568 B9 Ca0.129 Cr10.116 F1.083 Fe0.081 H8.811 K0.081 Mg6.255 Na2.526 O91.917 Si17.604 Ti0.009 V2.349 Zn0.027 -","3","0.166667","","Bosi, F.; Lucchesi, S.; Reznitskii, L.","Crystal chemistry of the dravite-chromdravite series Note: Tourmaline TMt3c","European Journal of Mineralogy","2004","16","","345","352","10.1127/0935-1221/2004/0016-0345","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005669","16.0204","","16.0204","","7.2985","","90","","90","","120","","1622.22","","","","","","","","","","","","Sludyanka crystalline complex, Lake Baikal, Russia","15","R 3 m :H","R 3 -2""","160","","","Chromdravite","- Al2.682 B3 Ca0.097 Cr3.9 F0.393 Fe0.042 H2.82 K0.014 Mg2.208 Na0.829 O30.607 Si5.982 Ti0.03 V0.147 Zn0.012 -","- Al2.682 B3 Ca0.097 Cr3.9 F0.393 Fe0.042 H2.82 K0.014 Mg2.208 Na0.829 O30.607 Si5.982 Ti0.03 V0.147 Zn0.012 -","- Al8.046 B9 Ca0.291 Cr11.7 F1.179 Fe0.126 H8.46 K0.042 Mg6.624 Na2.487 O91.821 Si17.946 Ti0.09 V0.441 Zn0.036 -","3","0.166667","","Bosi, F.; Lucchesi, S.; Reznitskii, L.","Crystal chemistry of the dravite-chromdravite series Note: Tourmaline TMpr79f","European Journal of Mineralogy","2004","16","","345","352","10.1127/0935-1221/2004/0016-0345","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005670","15.9911","","15.9911","","7.2764","","90","","90","","120","","1611.4","","","","","","","","","","","","Sludyanka crystalline complex, Lake Baikal, Russia","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al3.354 B3 Ca0.028 Cr3.15 F0.259 Fe0.036 H3.034 K0.022 Mg2.169 Na0.888 O30.741 Si5.988 Ti0.003 V0.279 Zn0.015 -","- Al3.354 B3 Ca0.028 Cr3.15 F0.259 Fe0.036 H3.034 K0.022 Mg2.169 Na0.888 O30.741 Si5.988 Ti0.003 V0.279 Zn0.015 -","- Al10.062 B9 Ca0.084 Cr9.45 F0.777 Fe0.108 H9.102 K0.066 Mg6.507 Na2.664 O92.223 Si17.964 Ti0.009 V0.837 Zn0.045 -","3","0.166667","","Bosi, F.; Lucchesi, S.; Reznitskii, L.","Crystal chemistry of the dravite-chromdravite series Note: Tourmaline TM1p43e","European Journal of Mineralogy","2004","16","","345","352","10.1127/0935-1221/2004/0016-0345","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9005687","15.9158","","15.9158","","7.1201","","90","","90","","120","","1561.97","","","","","","","","","","","","Eibenstein an der Thaya, Bohemian massif, Lower Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.68 B3 Ca0.03 F0.54 Fe0.06 H3.37 K0.01 Li0.54 Mn0.93 Na0.84 O30.46 Si5.76 Ti0.03 -","- Al7.68 B3 Ca0.03 F0.54 Fe0.06 H3.37 K0.01 Li0.54 Mn0.93 Na0.84 O30.46 Si5.76 Ti0.03 -","- Al23.04 B9 Ca0.09 F1.62 Fe0.18 H10.11 K0.03 Li1.62 Mn2.79 Na2.52 O91.38 Si17.28 Ti0.09 -","3","0.166667","","Ertl, A.; Schuster, R.; Prowatke, S.; Brandstatter, F.; Ludwig, T.; Bernhardt, H. J.; Koller, F.; Hughes, J. M.","Mn-rich tourmaline and fluorapatite in a Variscan pegmatite from Eibenstein an der Thaya, Bohemian massif, Lower Austria","European Journal of Mineralogy","2004","16","","551","560","10.1127/0935-1221/2004/0016-0551","","","","","","","","","","","","","","","","","","","","","has coordinates","283868","2023-05-18","14:40:10","" "9005689","15.9443","","15.9443","","7.2094","","90","","90","","120","","1587.23","","","","","","","","","","","","Syros, Greece","11","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.91 B3.18 Ca0.02 F0.07 Fe0.63 H3.93 Mg2.37 Na0.96 O30.93 Si5.82 Ti0.06 -","- Al5.91 B3.18 Ca0.02 F0.07 Fe0.63 H3.93 Mg2.37 Na0.96 O30.93 Si5.82 Ti0.06 -","- Al17.73 B9.54 Ca0.06 F0.21 Fe1.89 H11.79 Mg7.11 Na2.88 O92.79 Si17.46 Ti0.18 -","3","0.166667","","Marschall, H. R.; Ertl, A.; Hughes, J. M.; McCammon, C. A.","Metamorphic Na- and OH-rich disordered dravite with tetrahedral boron, associated with omphacite, from Syros, Greece: chemistry and structure Sample: SY309B","European Journal of Mineralogy","2004","16","","817","823","10.1127/0935-1221/2004/0016-0817","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:46","" "9007661","3.163","","3.163","","18.37","","90","","90","","120","","159.162","","","","","","","","","","","","Synthetic","2","R 3 m :H","R 3 -2""","160","","","Molybdenite","- Mo S2 -","- Mo S2 -","- Mo3 S6 -","3","0.166667","","Schonfeld, B.; Huang, J. J.; Moss, S. C.","Anisotropic mean-square displacements (MSD) in single crystals of 2H- and 3R-MoS2 Note: 3R polytype","Acta Crystallographica, Section B","1983","39","4","404","407","10.1107/S0108768183002645","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04","" "9008157","17.758","","17.758","","7.807","","90","","90","","120","","2132.08","","","","","","","","","","","","Wiesloch, Germany","3","R 3 m :H","R 3 -2""","160","","","Gratonite","- As4 Pb9 S15 -","- As4 Pb9 S15 -","- As12 Pb27 S45 -","3","0.166667","","Ribar, B.; Nowacki, W.","Neubestimmung der kristallstruktur von gratonit, Pb9As4S15","Zeitschrift fur Kristallographie","1969","128","","321","338","10.1524/zkri.1969.128.3-6.321","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05","" "9009148","3.16","","3.16","","18.45","","90","","90","","120","","159.552","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","","- Mo S2 -","- Mo S2 -","- Mo3 S6 -","3","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York","Crystal Structures","1963","1","","280","281","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30","" "9009265","7.078","","7.078","","24.94","","90","","90","","120","","1082.05","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","Hatrurite","- Ca9 O15 Si3 -","- Ca9 O14.9999 Si3 -","- Ca27 O44.9997 Si9 -","3","0.166667","","O'Daniel H; Hellner, E.","Zur struktur von 3CaO*SiO2","Neues Jahrbuch fur Mineralogie, Monatshefte","1950","1950","","108","111","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30","" "9009291","7.0363","","7.0363","","17.28188","","90","","90","","120","","740.987","","","","","","","","","","","","Glen Alice area, New South Wales, Australia","6","R 3 m :H","R 3 -2""","160","","","Gorceixite","- Al3 Ba0.95 H6 O14 P2 Sr0.01 -","- Al3 Ba0.95 H6 O14 P2 Sr0.01 -","- Al9 Ba2.85 H18 O42 P6 Sr0.03 -","3","0.166667","","Radoslovich, E. W.; Slade, P. G.","Pseudo-trigonal symmetry and the structure of gorceixite","Neues Jahrbuch fur Mineralogie, Monatshefte","1980","1980","","157","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47","" "9009315","15.916","","15.916","","7.13","","90","","90","","120","","1564.19","","","","","","","","","","","","Zambia","9","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.53 B3 Ca0.04 H4 Li0.42 Mn0.93 Na0.85 O31 Si6 -","- Al7.53 B3 Ca0.04 H4 Li0.42 Mn0.93 Na0.85 O31 Si6 -","- Al22.59 B9 Ca0.12 H12 Li1.26 Mn2.79 Na2.55 O93 Si18 -","3","0.166667","","Nuber, B.; Schmetzer, K.","Structural refinement of tsilaisite (manganese tourmaline)","Neues Jahrbuch fur Mineralogie, Monatshefte","1984","1984","","301","304","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47","" "9009332","7.28","","7.28","","16.821","","90","","90","","120","","772.05","","","","","","","","","","","","Dernbach, Hessen-Nassau, Germany","6","R 3 m :H","R 3 -2""","160","","","Corkite","- Fe3 H6 O14 P Pb S -","- Fe3 H6 O14 P Pb S -","- Fe9 H18 O42 P3 Pb3 S3 -","3","0.166667","","Giuseppe, G.; Tadini, C.","Corkite, PbFe3(SO4)(PO4)(OH)6, its crystal structure and ordered arrangement of the tetrahedral cations Note: this is the prefered structure of these authors","Neues Jahrbuch fur Mineralogie, Monatshefte","1987","1987","","71","81","","","","","","","","","","","","","","","","","","","","","","has coordinates","293658","2024-08-03","10:24:26","" "9009439","3.13","","3.13","","23.49","","90","","90","","120","","199.298","","","","","","","","","","","","Sweden","5","R 3 m :H","R 3 -2""","160","","","Pyroaurite","- C0.125 H8 Fe0.25 Mg0.75 O2.875 -","- C0.125 H3.00002 Fe0.25 Mg0.75 O2.87501 -","- C0.375 H9.00006 Fe0.75 Mg2.25 O8.62503 -","3","0.166667","","Ingram, L.; Taylor, H. F. W.","The crystal structures of sjoegrenite and pyroaurite","Mineralogical Magazine","1967","36","","465","479","10.1180/minmag.1967.036.280.01","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:45","" "9009489","10.073","","10.073","","9.234","","90","","90","","120","","811.406","","","","","","","","","","","","Nkombwa Hill carbonatite, Zambia","5","R 3 m :H","R 3 -2""","160","","","Daqingshanite-(Ce)","- C3 Ce O13 P Sr3 -","- C3 Ce O13 P Sr3 -","- C9 Ce3 O39 P3 Sr9 -","3","0.166667","","Hughes, J. M.; Yunxiang, N.","A high-precision crystal structure refinement of daqingshanite-(Ce) from Nkombwa Hill carbonatite, Zambia","Mineralogical Magazine","1994","58","","493","496","10.1180/minmag.1994.058.392.17","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:31","" "9010125","15.8322","","15.8322","","7.1034","","90","","90","","120","","1541.98","","","","","","","","","","","","Anjanabonoina, Madagascar","10","R 3 m :H","R 3 -2""","160","","","Liddocoatite","- Al7.41 B3.12 Ca0.57 F0.76 H3.24 Li1.32 Mn0.06 Na0.29 O30.24 Si5.88 -","- Al7.41 B3.12 Ca0.57 F0.76 H3.24 Li1.32 Mn0.06 Na0.29 O30.24 Si5.88 -","- Al22.23 B9.36 Ca1.71 F2.28 H9.72 Li3.96 Mn0.18 Na0.87 O90.72 Si17.64 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Ludwig, T.; Prasad, P. S. R.; Brandstatter, F.; Korner, W.; Schuster, R.; Pertlik, F.; Marschall, H.","Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite series from Madagascar: Structure, chemistry, and infrared spectroscopic studies Locality: Anjanabonoina, Madagascar Sample: LID3NEW","American Mineralogist","2006","91","","1847","1856","10.2138/am.2006.2245","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09","" "9010126","15.8204","","15.8204","","7.0955","","90","","90","","120","","1537.97","","","","","","","","","","","","Anjanabonoina, Madagascar","11","R 3 m :H","R 3 -2""","160","","","Liddocoatite","- Al7.56 B3.24 Ca0.5 F0.56 Fe0.06 H3.441 Li1.14 Mn0.03 Na0.34 O30.44 Si5.76 -","- Al7.56 B3.24 Ca0.5 F0.56 Fe0.06 H3.441 Li1.14 Mn0.03 Na0.34 O30.44 Si5.76 -","- Al22.68 B9.72 Ca1.5 F1.68 Fe0.18 H10.323 Li3.42 Mn0.09 Na1.02 O91.32 Si17.28 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Ludwig, T.; Prasad, P. S. R.; Brandstatter, F.; Korner, W.; Schuster, R.; Pertlik, F.; Marschall, H.","Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite series from Madagascar: Structure, chemistry, and infrared spectroscopic studies Locality: Anjanabonoina, Madagascar Sample: LID6A1","American Mineralogist","2006","91","","1847","1856","10.2138/am.2006.2245","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09","" "9010127","15.8119","","15.8119","","7.0925","","90","","90","","120","","1535.67","","","","","","","","","","","","Anjanabonoina, Madagascar","11","R 3 m :H","R 3 -2""","160","","","Liddocoatite","- Al7.62 B3.3 Ca0.41 F0.51 Fe0.03 H3.489 Li1.08 Mn0.03 Na0.41 O30.49 Si5.7 -","- Al7.62 B3.3 Ca0.41 F0.51 Fe0.03 H3.489 Li1.08 Mn0.03 Na0.41 O30.49 Si5.7 -","- Al22.86 B9.9 Ca1.23 F1.53 Fe0.09 H10.467 Li3.24 Mn0.09 Na1.23 O91.47 Si17.1 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Ludwig, T.; Prasad, P. S. R.; Brandstatter, F.; Korner, W.; Schuster, R.; Pertlik, F.; Marschall, H.","Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite series from Madagascar: Structure, chemistry, and infrared spectroscopic studies Locality: Anjanabonoina, Madagascar Sample: LID52","American Mineralogist","2006","91","","1847","1856","10.2138/am.2006.2245","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09","" "9010128","15.8095","","15.8095","","7.0941","","90","","90","","120","","1535.55","","","","","","","","","","","","Anjanabonoina, Madagascar","9","R 3 m :H","R 3 -2""","160","","","Liddocoatite","- Al7.83 B3.42 Ca0.3 F0.5 H3.501 Li0.9 Na0.46 O30.5 Si5.58 -","- Al7.83 B3.42 Ca0.3 F0.5 H3.501 Li0.9 Na0.46 O30.5 Si5.58 -","- Al23.49 B10.26 Ca0.9 F1.5 H10.503 Li2.7 Na1.38 O91.5 Si16.74 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Ludwig, T.; Prasad, P. S. R.; Brandstatter, F.; Korner, W.; Schuster, R.; Pertlik, F.; Marschall, H.","Tetrahedrally-coordinated boron in tourmalines from the liddicoatite-elbaite series from Madagascar: Structure, chemistry, and infrared spectroscopic studies Locality: Anjanabonoina, Madagascar Sample: LC1","American Mineralogist","2006","91","","1847","1856","10.2138/am.2006.2245","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09","" "9010545","14.2277","","14.2277","","29.987","","90","","90","","120","","5256.94","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","18","R 3 m :H","R 3 -2""","160","","","Eudialyte","- Ca4.68 Ce0.45 Cl0.764 Fe2.28 H1.244 K0.3 La0.33 Mn1.86 Na13.02 Nb0.62 Nd0.12 O78.494 Si25.12 Sr0.12 Ta0.04 Ti0.06 Y0.18 Zr3 -","- Ca4.68 Ce0.45 Cl0.764 Fe2.28 K0.3 La0.33 Mn1.86 Na13.02 Nb0.62 Nd0.12 O78.494 Si25.12 Sr0.12 Ta0.04 Ti0.06 Y0.18 Zr3 -","- Ca14.04 Ce1.35 Cl2.292 Fe6.84 K0.9 La0.99 Mn5.58 Na39.06 Nb1.86 Nd0.36 O235.482 Si75.36 Sr0.36 Ta0.12 Ti0.18 Y0.54 Zr9 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #2","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010546","14.2602","","14.2602","","29.98","","90","","90","","120","","5279.75","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","17","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Ca4.8 Ce0.75 Cl1.08 Fe1.47 H0.93 K0.24 La0.51 Mn2.34 Na13.08 Nb0.78 Nd0.15 O76.47 Si24.93 Sr0.06 Ta0.07 Y0.18 Zr3 -","- Ca4.8 Ce0.75 Cl1.08 Fe1.47 K0.24 La0.51 Mn2.34 Na13.08 Nb0.78 Nd0.15 O76.47 Si24.93 Sr0.06 Ta0.07 Y0.18 Zr3 -","- Ca14.4 Ce2.25 Cl3.24 Fe4.41 K0.72 La1.53 Mn7.02 Na39.24 Nb2.34 Nd0.45 O229.41 Si74.79 Sr0.18 Ta0.21 Y0.54 Zr9 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #3 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010547","14.1854","","14.1854","","30.101","","90","","90","","120","","5245.6","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","17","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Ca3.72 Ce0.39 Cl0.4 Fe1.05 H1.58 K0.24 La0.24 Mn3.42 Na13.35 Nb0.79 Nd0.09 O76.7 Si25.33 Sr0.12 Ti0.12 Y0.12 Zr2.76 -","- Ca3.72 Ce0.39 Cl0.4 Fe1.05 K0.24 La0.24 Mn3.42 Na13.35 Nb0.79 Nd0.09 O76.7 Si25.33 Sr0.12 Ti0.12 Y0.12 Zr2.76 -","- Ca11.16 Ce1.17 Cl1.2 Fe3.15 K0.72 La0.72 Mn10.26 Na40.05 Nb2.37 Nd0.27 O230.1 Si75.99 Sr0.36 Ti0.36 Y0.36 Zr8.28 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #4 Note: additional sites with low but unreported occupancies excluded","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010549","14.2959","","14.2959","","30.084","","90","","90","","120","","5324.63","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","15","R 3 m :H","R 3 -2""","160","","","Khomyakovite","- Ca6.39 Ce0.039 Cl0.636 Fe2.1 H1.362 K0.36 La0.036 Mn0.81 Na11.37 Nb0.31 O77.092 Si25 Sr2.745 W0.52 Zr2.97 -","- Ca6.39 Ce0.039 Cl0.636 Fe2.1 K0.36 La0.036 Mn0.81 Na11.37 Nb0.31 O77.092 Si25 Sr2.745 W0.52 Zr2.97 -","- Ca19.17 Ce0.117 Cl1.908 Fe6.3 K1.08 La0.108 Mn2.43 Na34.11 Nb0.93 O231.276 Si75 Sr8.235 W1.56 Zr8.91 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #6","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010554","14.271","","14.271","","30.16","","90","","90","","120","","5319.5","","","","","","","","","","","","Gardiner complex, East Greenland","17","R 3 m :H","R 3 -2""","160","","","Eudialyte","- Ba0.06 Ca6.78 Ce0.06 Cl0.841 Fe1.05 H1.139 K0.3 La0.06 Mn1.44 Na11.64 Nb0.715 O76.004 Si25.38 Sr1.32 Ti0.345 Y0.06 Zr2.58 -","- Ba0.06 Ca6.78 Ce0.06 Cl0.841 Fe1.05 K0.3 La0.06 Mn1.44 Na11.64 Nb0.715 O76.004 Si25.38 Sr1.32 Ti0.345 Y0.06 Zr2.58 -","- Ba0.18 Ca20.34 Ce0.18 Cl2.523 Fe3.15 K0.9 La0.18 Mn4.32 Na34.92 Nb2.145 O228.012 Si76.14 Sr3.96 Ti1.035 Y0.18 Zr7.74 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #11","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010556","14.199","","14.199","","30.139","","90","","90","","120","","5262.29","","","","","","","","","","","","Amdrup Fjord, Kangerdlugssuaq intrusion, Eastern Greenland","20","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Al0.15 Ca3.36 Ce0.71 Cl0.269 F1.541 Fe0.75 H0.192 Hf0.06 K0.3 La0.58 Mn3.78 Na13.93 Nb0.55 Nd0.138 O75.752 Si25.11 Sr0.15 Ti0.2 Y0.42 Zr2.95 -","- Al0.15 Ca3.36 Ce0.69 Cl0.269 F1.541 Fe0.75 Hf0.06 K0.3 La0.57 Mn3.78 Na12.96 Nb0.55 Nd0.138 O75.752 Si25.11 Sr0.15 Ti0.2 Y0.42 Zr2.95 -","- Al0.45 Ca10.08 Ce2.07 Cl0.807 F4.623 Fe2.25 Hf0.18 K0.9 La1.71 Mn11.34 Na38.88 Nb1.65 Nd0.414 O227.256 Si75.33 Sr0.45 Ti0.6 Y1.26 Zr8.85 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #13","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","285096","2023-07-08","08:53:35","" "9010559","14.2784","","14.2784","","30.089","","90","","90","","120","","5312.48","","","","","","","","","","","","Mont Saint-Hilaire, Rouville County, Quebec, Canada","16","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Ca4.95 Ce0.582 Cl0.45 Fe1.05 H1.549 K0.33 La0.408 Mn2.49 Na13.05 Nb0.95 Nd0.15 O77.549 Si24.93 Sr0.72 Y0.24 Zr2.97 -","- Ca4.95 Ce0.582 Cl0.45 Fe1.05 K0.33 La0.408 Mn2.49 Na13.05 Nb0.95 Nd0.15 O77.549 Si24.93 Sr0.72 Y0.24 Zr2.97 -","- Ca14.85 Ce1.746 Cl1.35 Fe3.15 K0.99 La1.224 Mn7.47 Na39.15 Nb2.85 Nd0.45 O232.647 Si74.79 Sr2.16 Y0.72 Zr8.91 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #16","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010560","14.22","","14.22","","30.15","","90","","90","","120","","5279.8","","","","","","","","","","","","Locality: Burpala massif, Siberia, Russia","20","R 3 m :H","R 3 -2""","160","","","Kentbrooksite","- Al0.84 Ba0.03 Ca3.51 Ce0.573 Cl0.798 F1.2 Fe1.5 K0.285 La0.327 Mn2.16 Na12.96 Nb0.46 Nd0.327 O74.93 Si24.94 Sr0.57 Ti0.36 Y0.51 Yb0.141 Zr3.086 -","- Al0.84 Ba0.03 Ca3.51 Ce0.573 Cl0.798 F1.2 Fe1.5 K0.285 La0.327 Mn2.16 Na12.96 Nb0.46 Nd0.327 O74.93 Si24.94 Sr0.57 Ti0.36 Y0.51 Yb0.141 Zr3.086 -","- Al2.52 Ba0.09 Ca10.53 Ce1.719 Cl2.394 F3.6 Fe4.5 K0.855 La0.981 Mn6.48 Na38.88 Nb1.38 Nd0.981 O224.79 Si74.82 Sr1.71 Ti1.08 Y1.53 Yb0.423 Zr9.258 -","3","0.166667","","Johnsen, O.; Grice, J. D.","The crystal chemistry of the eudialyte group Sample: #17 Note: additional sites with low but unreported occupancies excluded Note: X2d reported but missing z-coordinate","The Canadian Mineralogist","1999","37","","865","891","","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9010664","6.508","","6.508","","18.52","","90","","90","","120","","679.308","","","","","","","","","","","","Alpine fissures at Pizzo Cervandone, Scherbadung, Central Alps","14","R 3 m :H","R 3 -2""","160","","","Cervandonite-(Ce)","- Al0.381 As1.16 Ca0.02 Ce0.44 Fe1.671 La0.21 Nd0.22 O13 Si1.68 Sn0.009 Th0.06 Ti0.939 U0.02 Y0.03 -","- Al0.381 As1.16 Ca0.02 Ce0.44 Fe1.671 La0.21 Nd0.22 O13 Si1.68 Sn0.009 Th0.06 Ti0.939 U0.02 Y0.03 -","- Al1.143 As3.48 Ca0.06 Ce1.32 Fe5.013 La0.63 Nd0.66 O39 Si5.04 Sn0.027 Th0.18 Ti2.817 U0.06 Y0.09 -","3","0.166667","","Demartin, F.; Gramaccioli, C. M.; Graeser, S.","The crystal structure of cervandonite-(Ce), an interesting example of As3+ - Si diadochy Note: Chemistry from original description of the mineral.","The Canadian Mineralogist","2008","46","","423","430","10.3749/canmin.46.2.423","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45","" "9010716","15.88","","15.88","","7.118","","90","","90","","120","","1554.5","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.483 H3.333 K0.105 Li2 Na0.412 O31 Si6 -","- Al6.99999 B3 Ca0.483 H3.33333 K0.105 Li2.00001 Na0.412 O31 Si6 -","- Al21 B9 Ca1.449 H9.99999 K0.315 Li6.00003 Na1.236 O93 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 1 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9010717","15.882","","15.882","","7.115","","90","","90","","120","","1554.23","","","","","","","","","","","","","9","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7 B3 Ca0.452 H3.333 K0.04 Li2 Na0.435 O31 Si6 -","- Al6.99999 B3 Ca0.452 H3.33333 K0.04 Li2.00001 Na0.435 O31 Si6 -","- Al21 B9 Ca1.356 H9.99999 K0.12 Li6.00003 Na1.305 O93 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 2 Locality: Madagascar","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9010751","15.997","","15.997","","7.179","","90","","90","","120","","1591.01","","","","","","","","","","","","pegmatite at Grasstein, Trentino-South Tyrol, Italy","13","R 3 m :H","R 3 -2""","160","","","Schorl","- Al19.35 B9 F2.28 Fe6.75 H17.72 K0.03 Mg0.09 Mn0.36 Na2.34 O90.72 Si17.64 Ti0.09 Zn0.09 -","- Al19.35 B9 F2.28 Fe6.75 H9 K0.03 Mg0.09 Mn0.36 Na2.34 O90.72 Si17.64 Ti0.09 Zn0.09 -","- Al19.35 B9 F2.28 Fe6.75 H9 K0.03 Mg0.09 Mn0.36 Na2.34 O90.72 Si17.64 Ti0.09 Zn0.09 -","1","0.0555556","","Ertl, A.; Kolitsch, U.; Prowatke, S.; Dyar, M. D.; Henry, D. J.","The F-analogue of schorl from Grasstein, Trentino - South Tyrol, Italy: crystal structure and chemistry Locality: pegmatite at Grasstein, Trentino-South Tyrol, Italy","European Journal of Mineralogy","2006","18","","583","588","10.1127/0935-1221/2006/0018-0583","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9011454","7.135","","7.135","","25.586","","90","","90","","120","","1128.03","","","","1473.15","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","Hatrurite","- Ca3 O4.987 Si -","- Ca3 O4.98664 Si -","- Ca27 O44.8798 Si9 -","9","0.5","","Nishi, F.; Takeuchi, Y.","The rhombohedral structure of tricalcium silicate at 1200 C Sample: T = 1200 C Note: cannot reconcile reported structure with reported bond lengths","Zeitschrift fur Kristallographie","1984","168","1-4","197","212","10.1524/zkri.1984.168.1-4.197","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:47","" "9011770","14.2828","","14.2828","","30.0222","","90","","90","","120","","5303.96","","","","","","","","","","","","Ilimaussaq alkaline complex, South Greenland","14","R 3 m :H","R 3 -2""","160","","","Taseqite","- Ca5.151 Cl1.74 Fe1.932 Hf0.051 K0.171 Mn1.503 Na10.65 Nb1.27 O76.401 Si24.45 Sn0.03 Sr3.87 Y0.138 Zr2.88 -","- Ca5.151 Cl1.74 Fe1.932 Hf0.051 K0.171 Mn1.503 Na10.719 Nb1.27 O76.401 Si24.45 Sn0.03 Sr3.87 Y0.138 Zr2.88 -","- Ca15.453 Cl5.22 Fe5.796 Hf0.153 K0.513 Mn4.509 Na32.157 Nb3.81 O229.203 Si73.35 Sn0.09 Sr11.61 Y0.414 Zr8.64 -","3","0.166667","","Petersen, O. V.; Johnsen, O.; Gault, R. A.; Niedermayr, G.; Grice, J. D.","Taseqite, a new member of the eudialyte group from the Ilimaussaq alkaline complex, South Greenland Locality: Ilimaussaq alkaline complex, South Greenland Note: water and OHs located at O20 and O21","Neues Jahrbuch fur Mineralogie, Monatshefte","2004","2004","","83","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:58","" "9012112","3.4728","","3.4728","","18.616","","90","","90","","120","","194.436","","","","4.2","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","Grokhovskyite","- Cr Cu S2 -","- Cr Cu S2 -","- Cr3 Cu3 S6 -","3","0.166667","","Engelsman, F. M. R.; Wiegers, G. A.; Jellinek, F.; VanLaar, B.","Crystal structures and magnetic structures of some metal chromium(III) sulfides and selenides Locality: synthetic Sample: T = 4.2 K","Journal of Solid State Chemistry","1973","6","","574","582","10.1016/S0022-4596(73)80018-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012113","3.4812","","3.4812","","18.697","","90","","90","","120","","196.228","","","","300","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","Grokhovskyite","- Cr Cu S2 -","- Cr Cu S2 -","- Cr3 Cu3 S6 -","3","0.166667","","Engelsman, F. M. R.; Wiegers, G. A.; Jellinek, F.; VanLaar, B.","Crystal structures and magnetic structures of some metal chromium(III) sulfides and selenides Locality: synthetic Sample: T = 300 K","Journal of Solid State Chemistry","1973","6","","574","582","10.1016/S0022-4596(73)80018-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012114","3.4884","","3.4884","","20.414","","90","","90","","120","","215.135","","","","4.2","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr S2 -","- Ag Cr S2 -","- Ag3 Cr3 S6 -","3","0.166667","","Engelsman, F. M. R.; Wiegers, G. A.; Jellinek, F.; VanLaar, B.","Crystal structures and magnetic structures of some metal chromium(III) sulfides and selenides Locality: synthetic Sample: T = 4.2 K","Journal of Solid State Chemistry","1973","6","","574","582","10.1016/S0022-4596(73)80018-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012115","3.4974","","3.4974","","20.481","","90","","90","","120","","216.956","","","","300","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr S2 -","- Ag Cr S2 -","- Ag3 Cr3 S6 -","3","0.166667","","Engelsman, F. M. R.; Wiegers, G. A.; Jellinek, F.; VanLaar, B.","Crystal structures and magnetic structures of some metal chromium(III) sulfides and selenides Locality: synthetic Sample: T = 300 K","Journal of Solid State Chemistry","1973","6","","574","582","10.1016/S0022-4596(73)80018-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012116","3.6898","","3.6898","","21.024","","90","","90","","120","","247.886","","","","4.2","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr Se2 -","- Ag Cr Se2 -","- Ag3 Cr3 Se6 -","3","0.166667","","Engelsman, F. M. R.; Wiegers, G. A.; Jellinek, F.; VanLaar, B.","Crystal structures and magnetic structures of some metal chromium(III) sulfides and selenides Locality: synthetic Sample: T = 4.2 K","Journal of Solid State Chemistry","1973","6","","574","582","10.1016/S0022-4596(73)80018-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012117","3.6809","","3.6809","","21.21","","90","","90","","120","","248.874","","","","300","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","","- Ag Cr Se2 -","- Ag Cr Se2 -","- Ag3 Cr3 Se6 -","3","0.166667","","Engelsman, F. M. R.; Wiegers, G. A.; Jellinek, F.; VanLaar, B.","Crystal structures and magnetic structures of some metal chromium(III) sulfides and selenides Locality: synthetic Sample: T = 300 K","Journal of Solid State Chemistry","1973","6","","574","582","10.1016/S0022-4596(73)80018-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012133","2.985","","2.985","","13.48","","90","","90","","120","","104.018","","","","","","","","","","","","","3","R 3 m :H","R 3 -2""","160","","","Grimaldiite (deuterated)","- Cr D O2 -","- Cr D O2 -","- Cr3 D3 O6 -","3","0.166667","","Christensen, A. N.; Hansen, P.; Lehmann, M. S.","Isotope effects in the bonds of alpha-CrOOH and alpha-CrOOD Locality: synthetic","Journal of Solid State Chemistry","1977","21","","325","329","10.1016/0022-4596(77)90130-X","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012135","2.979","","2.979","","13.37","","90","","90","","120","","102.755","","","","300","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","Grimaldiite","- Cr H O2 -","- Cr H O2 -","- Cr3 H3 O6 -","3","0.166667","","Christensen, A. N.; Hansen, P.; Lehmann, M. S.","Isotope effects in the bonds of alpha-CrOOH and alpha-CrOOD Sample: T = 300 K","Journal of Solid State Chemistry","1977","21","","325","329","10.1016/0022-4596(77)90130-X","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012186","8.006","","8.006","","6.863","","90","","90","","120","","380.957","","","","","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","Grattarolaite","- Fe3 O7 P -","- Fe3 O7 P -","- Fe9 O21 P3 -","3","0.166667","","Modaressi, A.; Courtois, A.; Gerardin, R.; Malaman, B.; Gleitzer, C.","Fe3PO7, un cas de coordinence 5 du fer trivalent, etude structurale et magnetique Locality: synthetic","Journal of Solid State Chemistry","1983","47","","245","255","10.1016/0022-4596(83)90016-6","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012192","3.158","","3.158","","18.49","","90","","90","","120","","159.695","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","Tungstenite","- S2 W -","- S2 W -","- S6 W3 -","3","0.166667","","Schutte, W. J.; de Boer, J. L.; Jellinek, F.","Crystal structures of tungsten disulfide and diselenide Sample: 3R polytype","Journal of Solid State Chemistry","1987","70","","207","209","10.1016/0022-4596(87)90057-0","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47","" "9012658","14.167","","14.167","","30.081","","90","","90","","120","","5228.52","","","","","","","","","","","","Mount Karnasurt, Lovozero alkaline massif, Kola Peninsula, Russia","16","R 3 m :H","R 3 -2""","160","","","Ikranite","- Ca3.3 Ce0.33 Cl0.74 Fe2.1 H18.453 K0.3 La0.132 Mn1.398 Na9.627 Nb0.1 Nd0.036 O79.661 Si24.3 Sr0.504 Ti0.1 Zr3.4 -","- Ca3.3 Ce0.33 Cl0.74 Fe2.1 H15.982 K0.3 La0.132 Mn1.398 Na9.627 Nb0.1 Nd0.036 O79.661 Si24.3 Sr0.504 Ti0.1 Zr3.4 -","- Ca9.9 Ce0.99 Cl2.22 Fe6.3 H47.946 K0.9 La0.396 Mn4.194 Na28.881 Nb0.3 Nd0.108 O238.983 Si72.9 Sr1.512 Ti0.3 Zr10.2 -","3","0.166667","","Rastsvetaeva, R. K.; Chukanov, N. V.","Ikranite: composition and structure of a new mineral of the eudialyte group","Crystallography Reports","2003","48","","717","720","10.1134/1.1612591","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:44","" "9012663","14.231","","14.231","","29.984","","90","","90","","120","","5258.85","","","","","","","","","","","","Kovdor massif, Kola Peninsula, Russia","14","R 3 m :H","R 3 -2""","160","","","Golyshevite","- C H6.82 Al0.08 Ca9.348 Ce0.102 Cl0.29 Fe2.19 K0.6 Mn0.3 Na10.44 Nb0.57 O78.53 Si24.66 Zr3 -","- C H4.24 Al0.08 Ca9.348 Ce0.102 Cl0.29 Fe2.19 K0.6 Mn0.3 Na10.44 Nb0.57 O78.53 Si24.66 Zr3 -","- C3 H12.72 Al0.24 Ca28.044 Ce0.306 Cl0.87 Fe6.57 K1.8 Mn0.9 Na31.32 Nb1.71 O235.59 Si73.98 Zr9 -","3","0.166667","","Rozenberg, K. A.; Rastsvetaeva, R. K.; Chukanov, N. V.; Verin, I. A.","Crystal structure of golyshevite","Crystallography Reports","2005","50","","539","543","10.1134/1.1996727","","","","","","","","","","","","","","","","","","","","","has coordinates","283907","2023-05-21","07:14:44","" "9012669","15.894","","15.894","","7.115","","90","","90","","120","","1556.58","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Liddicoatite","- Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.28 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03 -","- Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.28 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03 -","- Al21.24 B9 Ca1.86 F2.52 Fe1.98 H6.84 Li2.97 Mg0.72 Na0.96 O90.45 Si18 Ti0.09 -","3","0.166667","","Rozhdestvenskaya, I. V.; Bronzova, Y. M.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I.","Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic) Locality: Sangilen Upland, Tuva Republic","Crystallography Reports","2008","53","","223","227","10.1134/S1063774508020090","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09","" "9012747","14.262","","14.262","","29.949","","90","","90","","120","","5275.62","","","","","","","","","","","","Petrelius peak, Khibiny massif, Kola Peninsula, Russia","16","R 3 m :H","R 3 -2""","160","","","Georgbarsanovite","- Ba0.033 Ca6.333 Ce0.468 Cl1.6 Fe2.55 H7.38 K0.249 Mn1.188 Na12 Nb0.8 O81.18 Si25.2 Sr0.717 Ti0.06 Y0.132 Zr3.27 -","- Ba0.033 Ca6.333 Ce0.468 Cl1.6 Fe2.55 H6.98 K0.249 Mn1.188 Na12 Nb0.8 O78.18 Si25.2 Sr0.717 Ti0.06 Y0.132 Zr3.27 -","- Ba0.099 Ca18.999 Ce1.404 Cl4.8 Fe7.65 H20.94 K0.747 Mn3.564 Na36 Nb2.4 O234.54 Si75.6 Sr2.151 Ti0.18 Y0.396 Zr9.81 -","3","0.166667","","Ekimenkova, I. A.; Rastsvetaeva, R. K.; Khomyakov, A. P.","Crystal structure of the Fe,Cl-analogue of kentbrooksite","Doklady Chemistry","2000","370","","17","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26","" "9012749","14.167","","14.167","","30.081","","90","","90","","120","","5228.52","","","","","","","","","","","","Karnasurt Mountains, Lovozero massif, Kola Peninsula, Russia","14","R 3 m :H","R 3 -2""","160","","","Ikranite","- Ca3.3 Ce0.498 Cl0.26 Fe2.1 H14.43 K0.3 Mn1.398 Na9.63 Nb0.1 O79.16 Si24.3 Sr0.504 Ti0.1 Zr3.399 -","- Ca3.3 Ce0.498 Cl0.26 Fe2.1 H12.43 K0.3 Mn1.398 Na9.63 Nb0.1 O79.16 Si24.3 Sr0.504 Ti0.1 Zr3.399 -","- Ca9.9 Ce1.494 Cl0.78 Fe6.3 H37.29 K0.9 Mn4.194 Na28.89 Nb0.3 O237.48 Si72.9 Sr1.512 Ti0.3 Zr10.197 -","3","0.166667","","Ekimenkova, I. A.; Rastsvetaeva, R. K.; Chukanov, N. V.; Khasanov, S. S.","Crystal structure of an oxonium-containing analogue of eudialyte","Doklady Chemistry","2000","371","","65","69","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9012858","4.417","","4.417","","29.84","","90","","90","","120","","504.178","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","Tellurobismuthite","- Bi2 Te3 -","- Bi2 Te3 -","- Bi6 Te9 -","3","0.166667","","Atabaeva, E. Y.; Ickevich, E. S.; Mashkov, S. A.; Popova, S. V.; Vereshchagin, L. F.","The polymorphism of bismuth telluride under high pressures and temperatures","Fizika Tverdogo Tela","1968","10","","62","65","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48","" "9013193","15.9875","","15.9875","","7.2372","","90","","90","","120","","1602","","","","","","","","","","","","Uto Island, south of Stockholm, Sweden","13","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.28 B3 Ca0.29 F0.08 Fe1.449 H3.54 K0.01 Mg2.241 Mn0.021 Na0.64 O30.92 Si6 Ti0.009 -","- Al5.28 B3 Ca0.29 F0.08 Fe1.449 H3.54 K0.01 Mg2.241 Mn0.021 Na0.64 O30.92 Si6 Ti0.009 -","- Al15.84 B9 Ca0.87 F0.24 Fe4.347 H10.62 K0.03 Mg6.723 Mn0.063 Na1.92 O92.76 Si18 Ti0.027 -","3","0.166667","","Bosi, F.","Disordering of Fe2+ over octahedrally coordinated sites of tourmaline","American Mineralogist","2008","93","","1647","1653","10.2138/am.2008.2722","","","","","","","","","","","","","","","","","","","","","has coordinates","284046","2023-05-28","13:40:51","" "9013385","15.777","","15.777","","7.086","","90","","90","","120","","1527.5","","","","","","","","","","","","Sahatany Pegmatite Field, Manjaka, Sahatany Valley, Madagascar","10","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al8.001 B3.39 Ca0.09 Fe0.009 H6.6 Li0.9 Mn0.09 Na0.53 O31 Si5.61 -","- Al8.001 B3.39 Ca0.09 Fe0.009 H3.6 Li0.9 Mn0.09 Na0.53 O31 Si5.61 -","- Al24.003 B10.17 Ca0.27 Fe0.027 H10.8 Li2.7 Mn0.27 Na1.59 O93 Si16.83 -","3","0.166667","","Ertl, A.; Tillmanns, E.; Ntaflos, T.; Francis, C.; Giester, G.; Korner, W.; Hughes, J. M.; Lengauer, C.; Prem, M.","Tetrahedrally coordinated boron in Al-rich tourmaline and its relationship to the pressure-temperature conditions of formation Note: O5 and O6 z-coordinates changed to match reported bond lengths","European Journal of Mineralogy","2008","20","","881","888","10.1127/0935-1221/2008/0020-1869","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07","" "9013410","3.83","","3.83","","46.87999","","90","","90","","120","","595.547","","","","","","","","","","","","","2","R 3 m :H","R 3 -2""","160","","","Wurtzite-15R","- S5 Zn5 -","- S5 Zn5 -","- S15 Zn15 -","3","0.166667","","Frondel, C.; Palache, C.","Three new polymorphs of zinc sulfide","Science","1948","107","","602","602","10.1126/science.107.2788.602","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49","" "9013696","10.921","","10.921","","13.885","","90","","90","","120","","1434.17","","","","","","","","","","","","Koashva Mountain, Khibiny Massif, Kola Peninsula, Russia","6","R 3 m :H","R 3 -2""","160","","","Ivanyukite-Na-T","- H40 K1.56 Na4.32 O68 Si9 Ti12 -","- H36 K1.56 Na4.32 O66 Si9 Ti12 -","- H36 K1.56 Na4.32 O66 Si9 Ti12 -","1","0.0555556","","Yakovenchuk, V. N.; Nikolaev, A. P.; Selivanova, E. A.; Pakhomovsky, Y. A.; Korchak, J. A.; Spiridonova, D. V.; Zalkind, O. A.; Krivovichev, S. V.","Ivanyukite-Na-T, ivanyukite-Na-C, ivanyukite-K, and ivanyukite-Cu: New microporous titanosilicates from the Khibiny massif (Kola Peninsula, Russia) and crystal structure of ivanyukite-Na-T","American Mineralogist","2009","94","","1450","1458","10.2138/am.2009.3065","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26","" "9013698","15.929","","15.929","","7.183","","90","","90","","120","","1578.39","","","","","","","","","","","","","13","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.741 B3 Ca0.02 F0.19 Fe1.23 H3 K0.02 Mg0.978 Na0.86 O30.81 Si5.94 Ti0.111 Zn0.009 -","- Al6.741 B3 Ca0.02 F0.19 Fe1.23 H3 K0.02 Mg0.978 Na0.86 O30.81 Si5.94 Ti0.111 Zn0.009 -","- Al20.223 B9 Ca0.06 F0.57 Fe3.69 H9 K0.06 Mg2.934 Na2.58 O92.43 Si17.82 Ti0.333 Zn0.027 -","3","0.166667","","Ertl, A.; Marschall, H.; Geister, G.; Henry, D.; Schertl, H. P.; Ntaflos, T.; Luvizotto, G.; Nasdala, L.; Tillmanns, E.","Metamorphic ultrahigh-pressure tourmaline: structure, chemistry, and correlations to P-T conditions Locality: Saxonian Erzegebirge, Germany","American Mineralogist","2010","95","","1","10","10.2138/am.2010.3283","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49","" "9013699","15.935","","15.935","","7.201","","90","","90","","120","","1583.54","","","","","","","","","","","","","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.09 B3 Ca0.05 F0.32 Fe0.12 H6 K0.01 Mg2.679 Na0.9 O30.68 Si6 Ti0.03 -","- Al6.09 B3 Ca0.05 F0.32 Fe0.12 H6 K0.01 Mg2.679 Na0.9 O30.68 Si6 Ti0.03 -","- Al18.27 B9 Ca0.15 F0.96 Fe0.36 H18 K0.03 Mg8.037 Na2.7 O92.04 Si18 Ti0.09 -","3","0.166667","","Ertl, A.; Marschall, H.; Geister, G.; Henry, D.; Schertl, H. P.; Ntaflos, T.; Luvizotto, G.; Nasdala, L.; Tillmanns, E.","Metamorphic ultrahigh-pressure tourmaline: structure, chemistry, and correlations to P-T conditions Locality: Parigi, Dora Maira, Western Alps, Italy","American Mineralogist","2010","95","","1","10","10.2138/am.2010.3283","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49","" "9013700","15.945","","15.945","","7.21","","90","","90","","120","","1587.5","","","","","","","","","","","","","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.805 B3 Ca0.09 F0.39 Fe0.48 H3 K0.01 Mg2.643 Mn0.06 Na0.84 Ni0.021 O30.61 Si5.982 Ti0.021 Zn0.009 -","- Al5.805 B3 Ca0.09 F0.39 Fe0.48 H3 K0.01 Mg2.643 Mn0.06 Na0.84 Ni0.021 O30.61 Si5.982 Ti0.021 Zn0.009 -","- Al17.415 B9 Ca0.27 F1.17 Fe1.44 H9 K0.03 Mg7.929 Mn0.18 Na2.52 Ni0.063 O91.83 Si17.946 Ti0.063 Zn0.027 -","3","0.166667","","Ertl, A.; Marschall, H.; Geister, G.; Henry, D.; Schertl, H. P.; Ntaflos, T.; Luvizotto, G.; Nasdala, L.; Tillmanns, E.","Metamorphic ultrahigh-pressure tourmaline: structure, chemistry, and correlations to P-T conditions Locality: Lago di Cignana, Western Alps, Italy","American Mineralogist","2010","95","","1","10","10.2138/am.2010.3283","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:16","" "9014009","15.9537","","15.9537","","7.1448","","90","","90","","120","","1574.87","","","","","","","","","","","","Konigsalm, Moldanubian nappes, Lower Austria","13","R 3 m :H","R 3 -2""","160","","","Foitite","- Al6.873 B3 F0.05 Fe1.188 H5.85 Li0.021 Mg0.819 Mn0.081 Na0.37 O30.95 Si5.958 Ti0.009 Zn0.009 -","- Al6.873 B3 F0.05 Fe1.188 H5.85 Li0.021 Mg0.819 Mn0.081 Na0.37 O30.95 Si5.958 Ti0.009 Zn0.009 -","- Al20.619 B9 F0.15 Fe3.564 H17.55 Li0.063 Mg2.457 Mn0.243 Na1.11 O92.85 Si17.874 Ti0.027 Zn0.027 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample TK3","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014014","15.8675","","15.8675","","7.1135","","90","","90","","120","","1551.07","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.167 B3 Ca0.441 F0.681 Fe0.027 H3.318 Li1.278 Mn0.531 Na0.471 O30.318 Pb0.025 Si6 -","- Al7.167 B3 Ca0.441 F0.681 Fe0.027 H3 Li1.278 Mn0.531 Na0.471 O30.318 Pb0.025 Si6 -","- Al21.501 B9 Ca1.323 F2.043 Fe0.081 H9 Li3.834 Mn1.593 Na1.413 O90.954 Pb0.075 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L11, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014024","16.043","","16.043","","7.247","","90","","90","","120","","1615.33","","","","","","","","","","","","Blocherleitengraben, Lower Austria","9","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al5.451 B3 Ca0.062 F0.3 Fe3.549 H3.23 Na0.938 O30.7 Si6 -","- Al5.451 B3 Ca0.062 F0.3 Fe3.549 H3.23 Na0.938 O30.7 Si6 -","- Al16.353 B9 Ca0.186 F0.9 Fe10.647 H9.69 Na2.814 O92.1 Si18 -","3","0.166667","","Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E.","Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample bls2","American Mineralogist","2012","97","","1402","1416","10.2138/am.2012.4028","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50","" "9014051","15.8307","","15.8307","","7.1013","","90","","90","","120","","1541.23","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.287 B3 Ca0.685 F0.685 Fe0.06 H3.315 Li1.617 Mn0.036 Na0.245 O30.315 Pb0.01 Si6 Ti0.003 -","- Al7.287 B3 Ca0.685 F0.685 Fe0.06 H3 Li1.617 Mn0.036 Na0.245 O30.315 Pb0.01 Si6 Ti0.003 -","- Al21.861 B9 Ca2.055 F2.055 Fe0.18 H9 Li4.851 Mn0.108 Na0.735 O90.945 Pb0.03 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L16, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014058","15.941","","15.941","","7.201","","90","","90","","120","","1584.73","","","","","","","","","","","","Yinnietharra, Western Australia","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.109 B3.08 Ca0.09 F0.17 Fe0.06 H3.58 Li0.002 Mg2.73 Na0.82 O30.83 Si5.9 Ti0.11 -","- Al6.1092 B3.0798 Ca0.09 F0.17 Fe0.06 H3.58 Li0.0021 Mg2.7297 Na0.82 O30.83 Si5.8998 Ti0.1098 -","- Al18.3276 B9.2394 Ca0.27 F0.51 Fe0.18 H10.74 Li0.0063 Mg8.1891 Na2.46 O92.49 Si17.6994 Ti0.3294 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Dravite 43230","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:59","" "9014084","15.882","","15.882","","7.115","","90","","90","","120","","1554.23","","","","","","","","","","","","Madagascar","10","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7 B3 Ca0.452 F0.327 H3.39 K0.04 Li2 Na0.435 O30.672 Si6 -","- Al6.99999 B3 Ca0.452 F0.327 H3.39 K0.04 Li2.00001 Na0.435 O30.672 Si6 -","- Al21 B9 Ca1.356 F0.981 H10.17 K0.12 Li6.00003 Na1.305 O92.016 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 2","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9014094","15.8548","","15.8548","","7.1099","","90","","90","","120","","1547.8","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.173 B3 Ca0.517 F0.589 Fe0.09 H3.411 Li1.395 Mg0.102 Mn0.234 Na0.386 O30.411 Pb0.021 Si6 Ti0.003 -","- Al7.173 B3 Ca0.517 F0.589 Fe0.09 H3 Li1.395 Mg0.102 Mn0.234 Na0.386 O30.411 Pb0.021 Si6 Ti0.003 -","- Al21.519 B9 Ca1.551 F1.767 Fe0.27 H9 Li4.185 Mg0.306 Mn0.702 Na1.158 O91.233 Pb0.063 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L4, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014104","16.017","","16.017","","7.256","","90","","90","","120","","1612.09","","","","","","","","","","","","Madagascar","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al4.56 B3 Ca0.48 F0.18 Fe2.01 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al4.56 B3 Ca0.48 F0.18 Fe2.01 H6.18 K0.01 Mg2.19 Na0.49 O30.82 Si6 Ti0.21 -","- Al13.68 B9 Ca1.44 F0.54 Fe6.03 H18.54 K0.03 Mg6.57 Na1.47 O92.46 Si18 Ti0.63 -","3","0.166667","","Camara, F.; Ottolini, L.; Hawthorne, F. C.","Crystal chemistry of three tourmalines by SREF, EMPA and SIMS Sample: Crystal 1","American Mineralogist","2000","87","","1437","1442","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014112","10.501","","10.501","","11.555","","90","","90","","120","","1103.47","","","","","","","","","","","","Synthetic","3","R 3 m :H","R 3 -2""","160","","","Changbaiite","- Nb2 O6 Pb -","- Nb2 O6 Pb -","- Nb18 O54 Pb9 -","9","0.5","","Mahe, R.","Etude structurale du metaniobate de plombe rhomboedrique II. - Positions des atomes","Bulletin de la Societe Chimique de France","1967","1967","","1879","1884","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014133","15.746","","15.746","","7.075","","90","","90","","120","","1519.14","","","","","","","","","","","","synthetic at 500 C","7","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.55 B3.906 H3 Li0.45 Na0.79 O31 Si5.094 -","- Al8.55 B3.906 H3 Li0.45 Na0.79 O31 Si5.094 -","- Al25.65 B11.718 H9 Li1.35 Na2.37 O93 Si15.282 -","3","0.166667","","Ertl, A.; Giester, G.; Ludwig, T.; Meyer, H. P.; Rossman, G. R.","Synthetic B-rich olenite: Correlations of single-crystal structural data Note: sample ElbK-9","American Mineralogist","2012","97","","1591","1597","10.2138/am.2012.4060","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9014142","15.8363","","15.8363","","7.104","","90","","90","","120","","1542.91","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.224 B3 Ca0.636 F0.708 Fe0.045 H3.291 Li1.593 Mg0.003 Mn0.135 Na0.282 O30.291 Pb0.02 Si6 Ti0.003 -","- Al7.224 B3 Ca0.636 F0.708 Fe0.045 H3 Li1.593 Mg0.003 Mn0.135 Na0.282 O30.291 Pb0.02 Si6 Ti0.003 -","- Al21.672 B9 Ca1.908 F2.124 Fe0.135 H9 Li4.779 Mg0.009 Mn0.405 Na0.846 O90.873 Pb0.06 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L7, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014160","15.967","","15.967","","7.191","","90","","90","","120","","1587.69","","","","","","","","","","","","Silver Knob, Mariposa County, California, USA","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.94 B3 Ca0.36 Cr0.18 Fe0.18 H4 Mg2.04 Na0.46 O31 Si5.64 Ti0.06 V1.11 -","- Al5.94 B3 Ca0.36 Cr0.18 Fe0.18 H4 Mg2.04 Na0.46 O31 Si5.64 Ti0.06 V1.11 -","- Al17.82 B9 Ca1.08 Cr0.54 Fe0.54 H12 Mg6.12 Na1.38 O93 Si16.92 Ti0.18 V3.33 -","3","0.166667","","Foit, F. F.; Rosenberg, P. E.","The structure of vanadium-bearing tourmaline and its implications regarding tourmaline solid solutions","American Mineralogist","1979","64","","788","798","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014163","15.935","","15.935","","7.201","","90","","90","","120","","1583.54","","","","","","","","","","","","Parigi, Dora Maira, Western Alps, Italy","12","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.09 B3 Ca0.05 F0.28 Fe0.12 H6.72 K0.01 Mg2.679 Na0.9 O30.72 Si6 Ti0.03 -","- Al6.09 B3 Ca0.05 F0.28 Fe0.12 H6.72 K0.01 Mg2.679 Na0.9 O30.72 Si6 Ti0.03 -","- Al18.27 B9 Ca0.15 F0.84 Fe0.36 H20.16 K0.03 Mg8.037 Na2.7 O92.16 Si18 Ti0.09 -","3","0.166667","","Ertl, A.; Marschall, H.; Geister, G.; Henry, D.; Schertl, H. P.; Ntaflos, T.; Luvizotto, G.; Nasdala, L.; Tillmanns, E.","Metamorphic ultrahigh-pressure tourmaline: structure, chemistry, and correlations to P-T conditions","American Mineralogist","2010","95","","1","10","10.2138/am.2010.3283","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014168","15.8368","","15.8368","","7.1014","","90","","90","","120","","1542.44","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.194 B3 Ca0.66 F0.432 Fe0.093 H3.567 Li1.647 Mn0.051 Na0.272 O30.567 Pb0.005 Si6 Ti0.009 -","- Al7.194 B3 Ca0.66 F0.432 Fe0.093 H3 Li1.647 Mn0.051 Na0.272 O30.567 Pb0.005 Si6 Ti0.009 -","- Al21.582 B9 Ca1.98 F1.296 Fe0.279 H9 Li4.941 Mn0.153 Na0.816 O91.701 Pb0.015 Si18 Ti0.027 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L26, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014192","15.918","","15.918","","7.26","","90","","90","","120","","1593.1","","","","","","","","","","","","Blocherleitengraben, Lower Austria","7","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al5.478 B3 Ca0.029 Fe3.522 Na0.971 O31 Si6 -","- Al5.478 B3 Ca0.029 Fe3.522 Na0.971 O31 Si6 -","- Al16.434 B9 Ca0.087 Fe10.566 Na2.913 O93 Si18 -","3","0.166667","","Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E.","Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample bls2h2, heated a second time in air at 750 C for 72 h","American Mineralogist","2012","97","","1402","1416","10.2138/am.2012.4028","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014208","15.7713","","15.7713","","7.076","","90","","90","","120","","1524.24","","","","","","","","","","","","Koralpe, Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.517 B3.54 Be0.03 Ca0.241 Fe0.189 H3.32 Li0.342 Mg0.009 Mn0.006 Na0.48 O31 Si5.13 Ti0.009 -","- Al8.517 B3.54 Be0.03 Ca0.241 Fe0.189 H3.32 Li0.342 Mg0.009 Mn0.006 Na0.48 O31 Si5.13 Ti0.009 -","- Al25.551 B10.62 Be0.09 Ca0.723 Fe0.567 H9.96 Li1.026 Mg0.027 Mn0.018 Na1.44 O93 Si15.39 Ti0.027 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T2","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014215","15.7537","","15.7537","","7.0707","","90","","90","","120","","1519.7","","","","","","","","","","","","Koralpe, Austria","14","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.697 B3.618 Be0.036 Ca0.29 Fe0.084 H3.41 K0.002 Li0.366 Mg0.006 Mn0.009 Na0.408 O31 Si4.992 Ti0.006 -","- Al8.697 B3.618 Be0.036 Ca0.29 Fe0.084 H3.41 K0.002 Li0.366 Mg0.006 Mn0.009 Na0.408 O31 Si4.992 Ti0.006 -","- Al26.091 B10.854 Be0.108 Ca0.87 Fe0.252 H10.23 K0.006 Li1.098 Mg0.018 Mn0.027 Na1.224 O93 Si14.976 Ti0.018 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T1","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014221","15.8404","","15.8404","","7.1039","","90","","90","","120","","1543.69","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.203 B3 Ca0.63 F0.691 Fe0.123 H3.309 Li1.524 Mg0.069 Mn0.069 Na0.338 O30.309 Pb0.007 Si6 Ti0.012 -","- Al7.203 B3 Ca0.63 F0.691 Fe0.123 H3 Li1.524 Mg0.069 Mn0.069 Na0.338 O30.309 Pb0.007 Si6 Ti0.012 -","- Al21.609 B9 Ca1.89 F2.073 Fe0.369 H9 Li4.572 Mg0.207 Mn0.207 Na1.014 O90.927 Pb0.021 Si18 Ti0.036 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L28, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014317","15.8343","","15.8343","","7.1012","","90","","90","","120","","1541.91","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.296 B3 Ca0.682 F0.669 Fe0.045 H3.331 Li1.626 Mn0.027 Na0.248 O30.331 Pb0.009 Si6 Ti0.003 -","- Al7.296 B3 Ca0.682 F0.669 Fe0.045 H3 Li1.626 Mn0.027 Na0.248 O30.331 Pb0.009 Si6 Ti0.003 -","- Al21.888 B9 Ca2.046 F2.007 Fe0.135 H9 Li4.878 Mn0.081 Na0.744 O90.993 Pb0.027 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L19, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014368","15.883","","15.883","","7.1093","","90","","90","","120","","1553.18","","","","","","","","","","","","Maigen, Moldanubian nappes, Lower Austria","14","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.922 B6.15 Ca0.01 F0.26 Fe1.338 H8.22 K0.01 Li0.42 Mn0.798 Na0.56 O42.74 Si5.568 Ti0.018 Zn0.06 -","- Al8.922 B6.15 Ca0.01 F0.26 Fe1.338 H8.22 K0.01 Li0.42 Mn0.798 Na0.56 O42.74 Si5.568 Ti0.018 Zn0.06 -","- Al26.766 B18.45 Ca0.03 F0.78 Fe4.014 H24.66 K0.03 Li1.26 Mn2.394 Na1.68 O128.22 Si16.704 Ti0.054 Zn0.18 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample MAG","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9014372","15.869","","15.869","","7.188","","90","","90","","120","","1567.61","","","","","","","","","","","","Mexquitic, San Luis Potosi, Mexico","7","R 3 m :H","R 3 -2""","160","","","Fluor-buergerite","- Al6 B3 F Fe3 Na O30 Si6 -","- Al6 B3 F Fe3 Na O30 Si6 -","- Al18 B9 F3 Fe9 Na3 O90 Si18 -","3","0.166667","","Barton, R.","Refinement of the crystal structure of buergerite and the absolute orientation of tourmalines","Acta Crystallographica, Section B","1969","25","","1524","1533","10.1107/S0567740869004286","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9014381","15.8529","","15.8529","","7.1101","","90","","90","","120","","1547.47","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.194 B3 Ca0.563 F0.693 Fe0.015 H3.306 Li1.461 Mn0.33 Na0.354 O30.306 Pb0.026 Si6 -","- Al7.194 B3 Ca0.563 F0.693 Fe0.015 H3 Li1.461 Mn0.33 Na0.354 O30.306 Pb0.026 Si6 -","- Al21.582 B9 Ca1.689 F2.079 Fe0.045 H9 Li4.383 Mn0.99 Na1.062 O90.918 Pb0.078 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L2, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014449","15.8293","","15.8293","","7.1003","","90","","90","","120","","1540.74","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.335 B3 Ca0.688 F0.73 Fe0.03 H3.27 Li1.596 Mn0.033 Na0.239 O30.27 Pb0.009 Si6 Ti0.003 -","- Al7.335 B3 Ca0.688 F0.73 Fe0.03 H3 Li1.596 Mn0.033 Na0.239 O30.27 Pb0.009 Si6 Ti0.003 -","- Al22.005 B9 Ca2.064 F2.19 Fe0.09 H9 Li4.788 Mn0.099 Na0.717 O90.81 Pb0.027 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L18, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014456","16","","16","","7.248","","90","","90","","120","","1606.9","","","","","","","","","","","","Cuvier Island, New Zealand","10","R 3 m :H","R 3 -2""","160","","","Feruvite","- Al4.8 B3.12 Ca0.62 Fe1.98 H3.6 Mg2.04 Na0.4 O31 Si5.77 Ti0.28 -","- Al4.8003 B3.12 Ca0.62 Fe1.9803 H3.6 Mg2.0403 Na0.4 O31 Si5.7702 Ti0.2802 -","- Al14.4009 B9.36 Ca1.86 Fe5.9409 H10.8 Mg6.1209 Na1.2 O93 Si17.3106 Ti0.8406 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Feruvite 53776","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:59","" "9014458","15.8399","","15.8399","","7.103","","90","","90","","120","","1543.4","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.251 B3 Ca0.638 F0.668 Fe0.132 H3.332 Li1.566 Mg0.015 Mn0.03 Na0.284 O30.332 Pb0.006 Si6 Ti0.006 -","- Al7.251 B3 Ca0.638 F0.668 Fe0.132 H3 Li1.566 Mg0.015 Mn0.03 Na0.284 O30.332 Pb0.006 Si6 Ti0.006 -","- Al21.753 B9 Ca1.914 F2.004 Fe0.396 H9 Li4.698 Mg0.045 Mn0.09 Na0.852 O90.996 Pb0.018 Si18 Ti0.018 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L21, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:17","" "9014464","15.9461","","15.9461","","7.138","","90","","90","","120","","1571.87","","","","","","","","","","","","Grotta d'Oggi, San Pietro in Campo, island of Elba, Italy","8","R 3 m :H","R 3 -2""","160","","","Tsilaisite","- Al6 B3 H3 Li1.152 Mn1.848 Na0.754 O31 Si6 -","- Al6.102 B3 H3 Li1.152 Mn1.848 Na0.754 O30.9999 Si6 -","- Al18.306 B9 H9 Li3.456 Mn5.544 Na2.262 O92.9997 Si18 -","3","0.166667","","Bosi, F.; Skogby, H.; Agrosì G; Scandale, E.","Tsilaisite, NaMn3Al6(Si6O18)(BO3)3(OH)3OH, a new mineral species of the tourmaline supergroup from Grotta d'Oggi, San Pietro in Campo, island of Elba, Italy Note: this dataset represents the split atom model","American Mineralogist","2012","97","","989","994","10.2138/am.2012.4019","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014467","15.874","","15.874","","7.196","","90","","90","","120","","1570.34","","","","","","","","","","","","Mapimi, Durango, Mexico","11","R 3 m :H","R 3 -2""","160","","","Fluor-buergerite","- Al6.41 B3.1 Ca0.04 F0.74 Fe2.53 H1.35 Mg0.06 Na0.88 O30.26 Si5.83 Ti0.07 -","- Al6.4101 B3.1002 Ca0.04 F0.74 Fe2.5299 H1.35 Mg0.06 Na0.88 O30.26 Si5.8302 Ti0.0702 -","- Al19.2303 B9.3006 Ca0.12 F2.22 Fe7.5897 H4.05 Mg0.18 Na2.64 O90.78 Si17.4906 Ti0.2106 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Buergerite 43293","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:59","" "9014523","15.8286","","15.8286","","7.1012","","90","","90","","120","","1540.8","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.293 B3 Ca0.684 F0.712 Fe0.039 H3.288 Li1.62 Mn0.048 Na0.238 O30.288 Pb0.013 Si6 -","- Al7.293 B3 Ca0.684 F0.712 Fe0.039 H3 Li1.62 Mn0.048 Na0.238 O30.288 Pb0.013 Si6 -","- Al21.879 B9 Ca2.052 F2.136 Fe0.117 H9 Li4.86 Mn0.144 Na0.714 O90.864 Pb0.039 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L24, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014533","15.8418","","15.8418","","7.1044","","90","","90","","120","","1544.07","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.194 B3 Ca0.641 F0.696 Fe0.021 H3.303 Li1.605 Mn0.18 Na0.288 O30.303 Pb0.023 Si6 -","- Al7.194 B3 Ca0.641 F0.696 Fe0.021 H3 Li1.605 Mn0.18 Na0.288 O30.303 Pb0.023 Si6 -","- Al21.582 B9 Ca1.923 F2.088 Fe0.063 H9 Li4.815 Mn0.54 Na0.864 O90.909 Pb0.069 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L6, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014570","15.894","","15.894","","7.115","","90","","90","","120","","1556.58","","","","","","","","","","","","Sangilen Upland, Tuva Republic","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.43 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03 -","- Al7.08 B3 Ca0.62 F0.84 Fe0.66 H2.43 Li0.99 Mg0.24 Na0.32 O30.15 Si6 Ti0.03 -","- Al21.24 B9 Ca1.86 F2.52 Fe1.98 H7.29 Li2.97 Mg0.72 Na0.96 O90.45 Si18 Ti0.09 -","3","0.166667","","Rozhdestvenskaya, I. V.; Bronzova, Y. M.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Kuznetsova, L. G.; Bannova, I. I.","Refinement of the crystal structure of calcium-lithium-aluminum tourmaline from the pegmatite vein in the Sangilen Upland (Tuva Republic)","Crystallography Reports","2008","53","","223","227","10.1134/S1063774508020090","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014576","15.967","","15.967","","7.213","","90","","90","","120","","1592.55","","","","","","","","","","","","Landanai, Tanzania","11","R 3 m :H","R 3 -2""","160","","","Uvite","- Al5.7 B3 Ca0.64 F0.46 H3.32 K0.02 Mg3.24 Na0.34 O30.54 Si6 V0.06 -","- Al5.7 B3 Ca0.64 F0.46 H3.32 K0.02 Mg3.24 Na0.34 O30.54 Si6 V0.06 -","- Al17.1 B9 Ca1.92 F1.38 H9.96 K0.06 Mg9.72 Na1.02 O91.62 Si18 V0.18 -","3","0.166667","","Schmetzer, K.; Nuber, B.; Abraham, K.","Zur Kristallchemie Magnesium-reicher Turmaline","Neues Jahrbuch fur Mineralogie, Abhandlungen","1979","136","","93","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9014583","15.917","","15.917","","7.252","","90","","90","","120","","1591.15","","","","","","","","","","","","Blocherleitengraben, Lower Austria","7","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al5.466 B3 Ca0.03 Fe3.534 Na0.97 O31 Si6 -","- Al5.466 B3 Ca0.03 Fe3.534 Na0.97 O31 Si6 -","- Al16.398 B9 Ca0.09 Fe10.602 Na2.91 O93 Si18 -","3","0.166667","","Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E.","Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample bls2h1, heated in air at 700 C for 10 h","American Mineralogist","2012","97","","1402","1416","10.2138/am.2012.4028","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014596","15.8333","","15.8333","","7.1025","","90","","90","","120","","1542","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.272 B3 Ca0.614 F0.633 Fe0.156 H3.367 Li1.482 Mg0.018 Mn0.057 Na0.311 O30.367 Pb0.006 Si6 Ti0.018 -","- Al7.272 B3 Ca0.614 F0.633 Fe0.156 H3 Li1.482 Mg0.018 Mn0.057 Na0.311 O30.367 Pb0.006 Si6 Ti0.018 -","- Al21.816 B9 Ca1.842 F1.899 Fe0.468 H9 Li4.446 Mg0.054 Mn0.171 Na0.933 O91.101 Pb0.018 Si18 Ti0.054 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L27, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014601","15.88","","15.88","","7.118","","90","","90","","120","","1554.5","","","","","","","","","","","","Madagascar","10","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7 B3 Ca0.483 F0.327 H3.291 K0.105 Li2 Na0.412 O30.672 Si6 -","- Al6.99999 B3 Ca0.483 F0.327 H3.291 K0.105 Li2.00001 Na0.412 O30.672 Si6 -","- Al21 B9 Ca1.449 F0.981 H9.873 K0.315 Li6.00003 Na1.236 O92.016 Si18 -","3","0.166667","","Aurisicchio, C.; Demartin, F.; Ottolini, L.; Pezzotta, F.","Homogeneous liddicoatite from Madagascar: a possible reference material? First EMPA, SIMS and SREF data Sample: 1","European Journal of Mineralogy","1999","11","","237","242","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9014616","15.963","","15.963","","7.148","","90","","90","","120","","1577.41","","","","","","","","","","","","Jack Creek deposit, near Basin, Montana, USA","10","R 3 m :H","R 3 -2""","160","","","Schorl","- Al7.029 B3 F0.14 Fe1.761 H3.38 Mg0.33 Na0.55 O30.86 Si5.862 Ti0.018 -","- Al7.029 B3 F0.14 Fe1.761 H3.38 Mg0.33 Na0.55 O30.86 Si5.862 Ti0.018 -","- Al21.087 B9 F0.42 Fe5.283 H10.14 Mg0.99 Na1.65 O92.58 Si17.586 Ti0.054 -","3","0.166667","","Foit, F. F.","Crystal chemistry of alkali-deficient schorl and tourmaline structural relationships","American Mineralogist","1989","74","","422","431","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014620","15.8306","","15.8306","","7.0999","","90","","90","","120","","1540.91","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.239 B3 Ca0.683 F0.638 Fe0.063 H3.362 Li1.632 Mg0.027 Mn0.036 Na0.247 O30.362 Pb0.006 Si6 Ti0.003 -","- Al7.239 B3 Ca0.683 F0.638 Fe0.063 H3 Li1.632 Mg0.027 Mn0.036 Na0.247 O30.362 Pb0.006 Si6 Ti0.003 -","- Al21.717 B9 Ca2.049 F1.914 Fe0.189 H9 Li4.896 Mg0.081 Mn0.108 Na0.741 O91.086 Pb0.018 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L22, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014641","15.8368","","15.8368","","7.1014","","90","","90","","120","","1542.44","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.194 B3 Ca0.66 F0.434 Fe0.093 H3.566 Li1.647 Mn0.051 Na0.272 O30.566 Pb0.005 Si6 Ti0.009 -","- Al7.194 B3 Ca0.66 F0.434 Fe0.093 H3 Li1.647 Mn0.051 Na0.272 O30.566 Pb0.005 Si6 Ti0.009 -","- Al21.582 B9 Ca1.98 F1.302 Fe0.279 H9 Li4.941 Mn0.153 Na0.816 O91.698 Pb0.015 Si18 Ti0.027 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L26, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014662","15.853","","15.853","","7.12","","90","","90","","120","","1549.65","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.191 B3 Ca0.51 F0.753 Fe0.027 H3.246 Li1.359 Mn0.423 Na0.408 O30.246 Pb0.026 Si6 -","- Al7.191 B3 Ca0.51 F0.753 Fe0.027 H3 Li1.359 Mn0.423 Na0.408 O30.246 Pb0.026 Si6 -","- Al21.573 B9 Ca1.53 F2.259 Fe0.081 H9 Li4.077 Mn1.269 Na1.224 O90.738 Pb0.078 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L12, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014724","15.8299","","15.8299","","7.1009","","90","","90","","120","","1540.99","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.317 B3 Ca0.695 F0.678 Fe0.057 H3.51 Li1.569 Mg0.021 Mn0.033 Na0.24 O30.51 Pb0.007 Si6 Ti0.003 -","- Al7.317 B3 Ca0.695 F0.678 Fe0.057 H3 Li1.569 Mg0.021 Mn0.033 Na0.24 O30.51 Pb0.007 Si6 Ti0.003 -","- Al21.951 B9 Ca2.085 F2.034 Fe0.171 H9 Li4.707 Mg0.063 Mn0.099 Na0.72 O91.53 Pb0.021 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L23, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014795","15.8293","","15.8293","","7.1003","","90","","90","","120","","1540.74","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.335 B3 Ca0.688 F0.729 Fe0.03 H3.27 Li1.596 Mn0.033 Na0.239 O30.27 Pb0.009 Si6 Ti0.003 -","- Al7.335 B3 Ca0.688 F0.729 Fe0.03 H3 Li1.596 Mn0.033 Na0.239 O30.27 Pb0.009 Si6 Ti0.003 -","- Al22.005 B9 Ca2.064 F2.187 Fe0.09 H9 Li4.788 Mn0.099 Na0.717 O90.81 Pb0.027 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L18, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014808","15.945","","15.945","","7.21","","90","","90","","120","","1587.5","","","","","","","","","","","","Lago di Cignana, Western Alps, Italy","15","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.805 B3 Ca0.09 F0.35 Fe0.48 H3.65 K0.01 Mg2.643 Mn0.06 Na0.84 Ni0.021 O30.65 Si5.982 Ti0.021 Zn0.009 -","- Al5.805 B3 Ca0.09 F0.35 Fe0.48 H3.65 K0.01 Mg2.643 Mn0.06 Na0.84 Ni0.021 O30.65 Si5.982 Ti0.021 Zn0.009 -","- Al17.415 B9 Ca0.27 F1.05 Fe1.44 H10.95 K0.03 Mg7.929 Mn0.18 Na2.52 Ni0.063 O91.95 Si17.946 Ti0.063 Zn0.027 -","3","0.166667","","Ertl, A.; Marschall, H.; Geister, G.; Henry, D.; Schertl, H. P.; Ntaflos, T.; Luvizotto, G.; Nasdala, L.; Tillmanns, E.","Metamorphic ultrahigh-pressure tourmaline: structure, chemistry, and correlations to P-T conditions","American Mineralogist","2010","95","","1","10","10.2138/am.2010.3283","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014864","15.8449","","15.8449","","7.1053","","90","","90","","120","","1544.87","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.209 B3 Ca0.583 F0.648 Fe0.015 H3.351 Li1.491 Mg0.06 Mn0.033 Na0.345 O30.351 Pb0.006 Si6 Ti0.009 -","- Al7.209 B3 Ca0.583 F0.648 Fe0.015 H3 Li1.491 Mg0.06 Mn0.033 Na0.345 O30.351 Pb0.006 Si6 Ti0.009 -","- Al21.627 B9 Ca1.749 F1.944 Fe0.045 H9 Li4.473 Mg0.18 Mn0.099 Na1.035 O91.053 Pb0.018 Si18 Ti0.027 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L13, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014875","15.8529","","15.8529","","7.1101","","90","","90","","120","","1547.47","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.194 B3 Ca0.563 F0.694 Fe0.015 H3.306 Li1.461 Mn0.33 Na0.354 O30.306 Pb0.026 Si6 -","- Al7.194 B3 Ca0.563 F0.694 Fe0.015 H3 Li1.461 Mn0.33 Na0.354 O30.306 Pb0.026 Si6 -","- Al21.582 B9 Ca1.689 F2.082 Fe0.045 H9 Li4.383 Mn0.99 Na1.062 O90.918 Pb0.078 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L2, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014883","15.765","","15.765","","7.083","","90","","90","","120","","1524.53","","","","","","","","","","","","synthetic at 600 C","7","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.61 B3.546 H3 Li0.39 Na0.68 O31 Si5.454 -","- Al8.61 B3.546 H3 Li0.39 Na0.68 O31 Si5.454 -","- Al25.83 B10.638 H9 Li1.17 Na2.04 O93 Si16.362 -","3","0.166667","","Ertl, A.; Giester, G.; Ludwig, T.; Meyer, H. P.; Rossman, G. R.","Synthetic B-rich olenite: Correlations of single-crystal structural data Note: sample ElbK-13","American Mineralogist","2012","97","","1591","1597","10.2138/am.2012.4060","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9014916","15.941","","15.941","","7.136","","90","","90","","120","","1570.42","","","","","","","","","","","","Eibenstein an der Thaya, Lower Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.407 B3 Ca0.032 F0.48 Fe0.018 H3.33 K0.004 Li0.483 Mn1.143 Na0.773 O30.52 Si5.826 Ti0.006 -","- Al7.407 B3 Ca0.032 F0.48 Fe0.018 H3.33 K0.004 Li0.483 Mn1.143 Na0.773 O30.52 Si5.826 Ti0.006 -","- Al22.221 B9 Ca0.096 F1.44 Fe0.054 H9.99 K0.012 Li1.449 Mn3.429 Na2.319 O91.56 Si17.478 Ti0.018 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Rossman, G. R.; London, D.; Fritz, E. A.","Mn-rich tourmaline from Austria: structure, chemistry, optical spectra, and relations to synthetic solid solutions Note: This sample may be named wrong Sample P6","American Mineralogist","2003","88","","1369","1376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014927","15.921","","15.921","","7.175","","90","","90","","120","","1575.05","","","","","","","","","","","","Forshammar Bergslagen Province, Sweden","11","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6 B3 Ca0.05 F0.038 Fe0.231 H3.42 K0.01 Mg2.769 Na0.711 O30.962 Si6 -","- Al6 B3 Ca0.05 F0.038 Fe0.231 H3.42 K0.01 Mg2.769 Na0.711 O30.962 Si6 -","- Al18 B9 Ca0.15 F0.114 Fe0.693 H10.26 K0.03 Mg8.307 Na2.133 O92.886 Si18 -","3","0.166667","","Bacik, P.; Uher, P.; Ertl, A.; Jonsson, E.; Nysten, P.; Kanicky, V.; Vaculovic, T.","Zoned REE-enriched dravite from a granitic pegmatite in Forshammar Bergslagen Province, Sweden: An EMPA, XRD and LA-ICP-MS study Sample: TSW an3 (rim)","The Canadian Mineralogist","2012","50","","825","841","10.3749/canmin.50.4.825","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014941","15.929","","15.929","","7.183","","90","","90","","120","","1578.39","","","","","","","","","","","","Saxonian Erzegebirge, Germany","13","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.741 B3 Ca0.02 F0.1 Fe1.23 H3.09 K0.02 Mg0.978 Na0.86 O30.9 Si5.94 Ti0.111 Zn0.009 -","- Al6.741 B3 Ca0.02 F0.1 Fe1.23 H3.09 K0.02 Mg0.978 Na0.86 O30.9 Si5.94 Ti0.111 Zn0.009 -","- Al20.223 B9 Ca0.06 F0.3 Fe3.69 H9.27 K0.06 Mg2.934 Na2.58 O92.7 Si17.82 Ti0.333 Zn0.027 -","3","0.166667","","Ertl, A.; Marschall, H.; Geister, G.; Henry, D.; Schertl, H. P.; Ntaflos, T.; Luvizotto, G.; Nasdala, L.; Tillmanns, E.","Metamorphic ultrahigh-pressure tourmaline: structure, chemistry, and correlations to P-T conditions","American Mineralogist","2010","95","","1","10","10.2138/am.2010.3283","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014979","15.955","","15.955","","7.153","","90","","90","","120","","1576.93","","","","","","","","","","","","the Crabtree Emerald mine, Mitchell County, North Carolina, USA","13","R 3 m :H","R 3 -2""","160","","","Fluor-dravite","- Al6.03 B3 Ca0.04 F0.61 Fe0.87 H3.39 Li0.12 Mg1.83 Mn0.09 Na0.88 O30.39 Si6 Ti0.03 -","- Al6.03 B3 Ca0.04 F0.61 Fe0.87 H3.39 Li0.12 Mg1.83 Mn0.09 Na0.88 O30.39 Si6 Ti0.03 -","- Al18.09 B9 Ca0.12 F1.83 Fe2.61 H10.17 Li0.36 Mg5.49 Mn0.27 Na2.64 O91.17 Si18 Ti0.09 -","3","0.166667","","Clark, C. M.; Hawthorne, F. C.; Ottolini, L.","Fluor-dravite, NaMg3Al6Si6O18(BO3)3(OH)3F, a new mineral species of the tourmaline group from the Crabtree Emerald mine, Mitchell County, North Carolina: Description and crystal structure","The Canadian Mineralogist","2011","49","","57","62","10.3749/canmin.49.1.57","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9014982","15.8307","","15.8307","","7.1013","","90","","90","","120","","1541.23","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.287 B3 Ca0.685 F0.684 Fe0.06 H3.315 Li1.617 Mn0.036 Na0.245 O30.315 Pb0.01 Si6 Ti0.003 -","- Al7.287 B3 Ca0.685 F0.684 Fe0.06 H3 Li1.617 Mn0.036 Na0.245 O30.315 Pb0.01 Si6 Ti0.003 -","- Al21.861 B9 Ca2.055 F2.052 Fe0.18 H9 Li4.851 Mn0.108 Na0.735 O90.945 Pb0.03 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L16, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9014984","15.9476","","15.9476","","7.1578","","90","","90","","120","","1576.53","","","","","","","","","","","","Konigsalm, Moldanian nappes, Lower Austria","12","R 3 m :H","R 3 -2""","160","","","Magnesiofoitite","- Al6.696 B3 F0.03 Fe1.2 H3.91 Li0.009 Mg1.032 Mn0.039 Na0.49 O30.97 Si5.952 Ti0.009 -","- Al6.696 B3 F0.03 Fe1.2 H3.91 Li0.009 Mg1.032 Mn0.039 Na0.49 O30.97 Si5.952 Ti0.009 -","- Al20.088 B9 F0.09 Fe3.6 H11.73 Li0.027 Mg3.096 Mn0.117 Na1.47 O92.91 Si17.856 Ti0.027 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample TK42","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015006","15.8456","","15.8456","","7.1066","","90","","90","","120","","1545.29","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.188 B3 Ca0.628 F0.702 Fe0.021 H3.298 Li1.584 Mn0.207 Na0.297 O30.298 Pb0.023 Si6 -","- Al7.188 B3 Ca0.628 F0.702 Fe0.021 H3 Li1.584 Mn0.207 Na0.297 O30.298 Pb0.023 Si6 -","- Al21.564 B9 Ca1.884 F2.106 Fe0.063 H9 Li4.752 Mn0.621 Na0.891 O90.894 Pb0.069 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L5, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9015030","15.853","","15.853","","7.12","","90","","90","","120","","1549.65","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.191 B3 Ca0.51 F0.752 Fe0.027 H3.248 Li1.359 Mn0.423 Na0.408 O30.248 Pb0.026 Si6 -","- Al7.191 B3 Ca0.51 F0.752 Fe0.027 H3 Li1.359 Mn0.423 Na0.408 O30.248 Pb0.026 Si6 -","- Al21.573 B9 Ca1.53 F2.256 Fe0.081 H9 Li4.077 Mn1.269 Na1.224 O90.744 Pb0.078 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L12, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9015035","15.8636","","15.8636","","7.1119","","90","","90","","120","","1549.96","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.239 B3 Ca0.487 F0.709 Fe0.111 H3.291 Li1.287 Mn0.363 Na0.435 O30.291 Pb0.022 Si6 Ti0.003 -","- Al7.239 B3 Ca0.487 F0.709 Fe0.111 H3 Li1.287 Mn0.363 Na0.435 O30.291 Pb0.022 Si6 Ti0.003 -","- Al21.717 B9 Ca1.461 F2.127 Fe0.333 H9 Li3.861 Mn1.089 Na1.305 O90.873 Pb0.066 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L1, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:18","" "9015067","15.9083","","15.9083","","7.1229","","90","","90","","120","","1561.11","","","","","","","","","","","","Urubu mine, Minas Gerais, Brazil","12","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al21.6 B9 Ca0.06 F2.1 Fe2.727 H17.57 Li2.223 Mn0.27 Na2.49 O90.9 Si18 Zn0.18 -","- Al21.6 B9 Ca0.06 F2.1 Fe2.727 H9.57 Li2.223 Mn0.27 Na2.49 O90.9 Si18 Zn0.18 -","- Al21.6 B9 Ca0.06 F2.1 Fe2.727 H9.57 Li2.223 Mn0.27 Na2.49 O90.9 Si18 Zn0.18 -","1","0.0555556","","Bosi, F.; Andreozzi, G. B.; Skogby, H.; Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.","Fluor-elbaite, Na(Li1.5Al1.5)Al6(Si6O18)(BO3)3(OH)3F, a new mineral species of the tourmaline supergroup Note: standard SREF","American Mineralogist","2013","98","","297","303","10.2138/am.2013.4285","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07","" "9015090","15.846","","15.846","","7.119","","90","","90","","120","","1548.06","","","","","","","","","","","","Minas Gerais, Brazil","11","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al7.53 B3.18 Ca0.03 F0.63 Fe0.03 H3.33 Li1.02 Mn0.39 Na0.66 O30.36 Si5.82 -","- Al7.53 B3.18 Ca0.03 F0.63 Fe0.03 H3.33 Li1.02 Mn0.39 Na0.66 O30.36 Si5.82 -","- Al22.59 B9.54 Ca0.09 F1.89 Fe0.09 H9.99 Li3.06 Mn1.17 Na1.98 O91.08 Si17.46 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Elbaite 55224","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015102","15.923","","15.923","","7.201","","90","","90","","120","","1581.15","","","","","","","","","","","","Gerevi Hills, Tanzania","9","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.63 B3 Ca0.29 H3.75 K0.02 Mg2.37 Na0.6 O31 Si6 -","- Al6.63 B3 Ca0.29 H3.75 K0.02 Mg2.37 Na0.6 O31 Si6 -","- Al19.89 B9 Ca0.87 H11.25 K0.06 Mg7.11 Na1.8 O93 Si18 -","3","0.166667","","Schmetzer, K.; Nuber, B.; Abraham, K.","Zur Kristallchemie Magnesium-reicher Turmaline","Neues Jahrbuch fur Mineralogie, Abhandlungen","1979","136","","93","112","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:34","" "9015134","15.973","","15.973","","7.213","","90","","90","","120","","1593.75","","","","","","","","","","","","Gouverneur, St. Lawrence Co., New York, USA","12","R 3 m :H","R 3 -2""","160","","","Fluor-uvite","- Al5.46 B3 Ca0.54 F0.62 Fe0.02 H3.33 Li0.006 Mg3.5 Na0.42 O30.38 Si5.99 Ti0.06 -","- Al5.46 B3 Ca0.54 F0.62 Fe0.0201 H3.33 Li0.006 Mg3.5088 Na0.42 O30.38 Si5.9898 Ti0.06 -","- Al16.38 B9 Ca1.62 F1.86 Fe0.0603 H9.99 Li0.018 Mg10.5264 Na1.26 O91.14 Si17.9694 Ti0.18 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Uvite 52210","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46","" "9015188","15.8303","","15.8303","","7.1017","","90","","90","","120","","1541.24","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.308 B3 Ca0.691 F0.678 Fe0.054 H3.321 Li1.611 Mg0.003 Mn0.024 Na0.234 O30.321 Pb0.006 Si6 Ti0.003 -","- Al7.308 B3 Ca0.691 F0.678 Fe0.054 H3 Li1.611 Mg0.003 Mn0.024 Na0.234 O30.321 Pb0.006 Si6 Ti0.003 -","- Al21.924 B9 Ca2.073 F2.034 Fe0.162 H9 Li4.833 Mg0.009 Mn0.072 Na0.702 O90.963 Pb0.018 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L20, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015204","15.935","","15.935","","7.16","","90","","90","","120","","1574.52","","","","","","","","","","","","Bald Mountain, Rangeley, Oxford County, Maine","15","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.026 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al6.516 B3 Ca0.156 Cr0.009 F0.06 Fe1.026 H3.094 K0.015 Mg1.359 Mn0.006 Na0.348 O30.94 Si6 Ti0.069 V0.006 -","- Al19.548 B9 Ca0.468 Cr0.027 F0.18 Fe3.078 H9.282 K0.045 Mg4.077 Mn0.018 Na1.044 O92.82 Si18 Ti0.207 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample O-T16-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015211","15.856","","15.856","","7.1079","","90","","90","","120","","1547.6","","","","","","","","","","","","pegmatite dikes near Sao Jose da Safira, Minas Gerais, Brazil","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.23 B3 Ca0.06 F0.54 Fe0.42 H3.46 Li1.02 Mg0.06 Mn0.18 Na0.73 O30.46 Si6 -","- Al7.23 B3 Ca0.06 F0.54 Fe0.42 H3.46 Li1.02 Mg0.06 Mn0.18 Na0.73 O30.46 Si6 -","- Al21.69 B9 Ca0.18 F1.62 Fe1.26 H10.38 Li3.06 Mg0.18 Mn0.54 Na2.19 O91.38 Si18 -","3","0.166667","","Diego Gatta, G.; Danisi, R. M.; Adamo, I.; Meven, M.; Diella, V.","A single-crystal neutron and X-ray diffraction study of elbaite Note: X-ray data","Physics and Chemistry of Minerals","2012","39","","577","588","10.1007/s00269-012-0513-0","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015245","15.987","","15.987","","7.163","","90","","90","","120","","1585.47","","","","","","","","","","","","Konigsalm, Moldanubian nappes, Lower Austria","15","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al6.591 B3.018 Ca0.05 F0.58 Fe1.896 H3.18 K0.01 Li0.069 Mg0.228 Mn0.288 Na0.76 O30.42 Si5.772 Ti0.12 Zn0.009 -","- Al6.591 B3.018 Ca0.05 F0.58 Fe1.896 H3.18 K0.01 Li0.069 Mg0.228 Mn0.288 Na0.76 O30.42 Si5.772 Ti0.12 Zn0.009 -","- Al19.773 B9.054 Ca0.15 F1.74 Fe5.688 H9.54 K0.03 Li0.207 Mg0.684 Mn0.864 Na2.28 O91.26 Si17.316 Ti0.36 Zn0.027 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample TK12","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015268","15.723","","15.723","","7.068","","90","","90","","120","","1513.21","","","","","","","","","","","","synthetic at 400 C","7","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.64 B4.2 H3 Li0.36 Na0.76 O31 Si4.8 -","- Al8.64 B4.2 H3 Li0.36 Na0.76 O31 Si4.8 -","- Al25.92 B12.6 H9 Li1.08 Na2.28 O93 Si14.4 -","3","0.166667","","Ertl, A.; Giester, G.; Ludwig, T.; Meyer, H. P.; Rossman, G. R.","Synthetic B-rich olenite: Correlations of single-crystal structural data Note: sample ElbK-11","American Mineralogist","2012","97","","1591","1597","10.2138/am.2012.4060","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9015347","15.8399","","15.8399","","7.103","","90","","90","","120","","1543.4","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.251 B3 Ca0.638 F0.666 Fe0.132 H3.333 Li1.566 Mg0.015 Mn0.03 Na0.284 O30.333 Pb0.006 Si6 Ti0.006 -","- Al7.251 B3 Ca0.638 F0.666 Fe0.132 H3 Li1.566 Mg0.015 Mn0.03 Na0.284 O30.333 Pb0.006 Si6 Ti0.006 -","- Al21.753 B9 Ca1.914 F1.998 Fe0.396 H9 Li4.698 Mg0.045 Mn0.09 Na0.852 O90.999 Pb0.018 Si18 Ti0.018 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L21, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015415","15.972","","15.972","","7.16","","90","","90","","120","","1581.84","","","","","","","","","","","","Cross Lake, Manitoba, Canada","11","R 3 m :H","R 3 -2""","160","","","Schorl","- Al6.393 B3.102 Fe2.106 H3.65 Li0.09 Mg0.171 Mn0.081 Na0.49 O31 Si5.898 Zn0.159 -","- Al6.393 B3.102 Fe2.106 H3.65 Li0.09 Mg0.171 Mn0.081 Na0.49 O31 Si5.898 Zn0.159 -","- Al19.179 B9.306 Fe6.318 H10.95 Li0.27 Mg0.513 Mn0.243 Na1.47 O93 Si17.694 Zn0.477 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Schorl CROSS","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015423","15.8343","","15.8343","","7.1012","","90","","90","","120","","1541.91","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.296 B3 Ca0.682 F0.669 Fe0.045 H3.33 Li1.626 Mn0.027 Na0.248 O30.33 Pb0.009 Si6 Ti0.003 -","- Al7.296 B3 Ca0.682 F0.669 Fe0.045 H3 Li1.626 Mn0.027 Na0.248 O30.33 Pb0.009 Si6 Ti0.003 -","- Al21.888 B9 Ca2.046 F2.007 Fe0.135 H9 Li4.878 Mn0.081 Na0.744 O90.99 Pb0.027 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L19, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015456","15.792","","15.792","","7.0878","","90","","90","","120","","1530.79","","","","","","","","","","","","Olenii Range, Kola Peninsula, Russia","12","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.217 B3.402 Ca0.023 Cl0.001 F0.161 Fe0.042 H3.832 Li0.63 Mn0.087 Na0.541 O30.838 Si5.454 -","- Al8.217 B3.402 Ca0.023 Cl0.001 F0.161 Fe0.042 H3.832 Li0.63 Mn0.087 Na0.541 O30.838 Si5.454 -","- Al24.651 B10.206 Ca0.069 Cl0.003 F0.483 Fe0.126 H11.496 Li1.89 Mn0.261 Na1.623 O92.514 Si16.362 -","3","0.166667","","Schreyer, W.; Hughes, J. M.; Bernhardt, H. J.; Kalt, A.; Prowatke, S.; Ertl, A.","Reexamination of olenite from the type locality: detection of boron in tetrahedral coordination Note: z-coordinate for AlY and y-coordinate for H were altered by Hughes, Aug 2003","European Journal of Mineralogy","2002","14","","935","942","10.1127/0935-1221/2002/0014-0935","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015535","15.8337","","15.8337","","7.1023","","90","","90","","120","","1542.04","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.296 B3 Ca0.645 F0.714 Fe0.009 H3.286 Li1.557 Mn0.03 Na0.282 O30.286 Pb0.009 Si6 Ti0.006 -","- Al7.296 B3 Ca0.645 F0.714 Fe0.009 H3 Li1.557 Mn0.03 Na0.282 O30.286 Pb0.009 Si6 Ti0.006 -","- Al21.888 B9 Ca1.935 F2.142 Fe0.027 H9 Li4.671 Mn0.09 Na0.846 O90.858 Pb0.027 Si18 Ti0.018 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L17, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015587","15.8548","","15.8548","","7.1099","","90","","90","","120","","1547.8","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.173 B3 Ca0.517 F0.588 Fe0.09 H3.411 Li1.395 Mg0.102 Mn0.234 Na0.386 O30.411 Pb0.021 Si6 Ti0.003 -","- Al7.173 B3 Ca0.517 F0.588 Fe0.09 H3 Li1.395 Mg0.102 Mn0.234 Na0.386 O30.411 Pb0.021 Si6 Ti0.003 -","- Al21.519 B9 Ca1.551 F1.764 Fe0.27 H9 Li4.185 Mg0.306 Mn0.702 Na1.158 O91.233 Pb0.063 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L4, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015599","15.981","","15.981","","7.21","","90","","90","","120","","1594.68","","","","","","","","","","","","Bronson Station, Hastings Co., Ontario, Canada","12","R 3 m :H","R 3 -2""","160","","","Fluor-dravite","- Al5.47 B3 Ca0.35 F0.44 Fe1.1 H3.21 Li0.039 Mg2.35 Na0.55 O30.56 Si5.98 Ti0.05 -","- Al5.4702 B3 Ca0.35 F0.44 Fe1.1001 H3 Li0.039 Mg2.3502 Na0.55 O30.56 Si5.9802 Ti0.0498 -","- Al16.4106 B9 Ca1.05 F1.32 Fe3.3003 H9 Li0.117 Mg7.0506 Na1.65 O91.68 Si17.9406 Ti0.1494 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Dravite 32008","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015603","15.8337","","15.8337","","7.1023","","90","","90","","120","","1542.04","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.296 B3 Ca0.645 F0.714 Fe0.009 H3.285 Li1.557 Mn0.03 Na0.282 O30.285 Pb0.009 Si6 Ti0.006 -","- Al7.296 B3 Ca0.645 F0.714 Fe0.009 H3 Li1.557 Mn0.03 Na0.282 O30.285 Pb0.009 Si6 Ti0.006 -","- Al21.888 B9 Ca1.935 F2.142 Fe0.027 H9 Li4.671 Mn0.09 Na0.846 O90.855 Pb0.027 Si18 Ti0.018 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L17, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015646","15.9013","","15.9013","","7.1213","","90","","90","","120","","1559.39","","","","","","","","","","","","Koralpe, Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.452 B3.336 Be0.012 Ca0.145 Fe1.203 H6.19 Li0.189 Mg0.087 Mn0.024 Na0.632 O31 Si5.526 Ti0.027 -","- Al7.452 B3.336 Be0.012 Ca0.145 Fe1.203 H6.19 Li0.189 Mg0.087 Mn0.024 Na0.632 O31 Si5.526 Ti0.027 -","- Al22.356 B10.008 Be0.036 Ca0.435 Fe3.609 H18.57 Li0.567 Mg0.261 Mn0.072 Na1.896 O93 Si16.578 Ti0.081 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T5","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015678","15.8449","","15.8449","","7.1053","","90","","90","","120","","1544.87","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.209 B3 Ca0.583 F0.647 Fe0.015 H3.353 Li1.491 Mg0.06 Mn0.033 Na0.345 O30.353 Pb0.006 Si6 Ti0.009 -","- Al7.209 B3 Ca0.583 F0.647 Fe0.015 H3 Li1.491 Mg0.06 Mn0.033 Na0.345 O30.353 Pb0.006 Si6 Ti0.009 -","- Al21.627 B9 Ca1.749 F1.941 Fe0.045 H9 Li4.473 Mg0.18 Mn0.099 Na1.035 O91.059 Pb0.018 Si18 Ti0.027 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L13, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292002","2024-05-23","10:01:19","" "9015712","15.8438","","15.8438","","7.1043","","90","","90","","120","","1544.44","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.14 B3 Ca0.61 F0.633 Fe0.12 H3.336 Li1.614 Mg0.057 Mn0.06 Na0.322 O30.336 Pb0.007 Si6 Ti0.006 -","- Al7.14 B3 Ca0.61 F0.633 Fe0.12 H3 Li1.614 Mg0.057 Mn0.06 Na0.322 O30.336 Pb0.007 Si6 Ti0.006 -","- Al21.42 B9 Ca1.83 F1.899 Fe0.36 H9 Li4.842 Mg0.171 Mn0.18 Na0.966 O91.008 Pb0.021 Si18 Ti0.018 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L25, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53","" "9015758","15.8333","","15.8333","","7.1025","","90","","90","","120","","1542","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.272 B3 Ca0.614 F0.633 Fe0.156 H3.366 Li1.482 Mg0.018 Mn0.057 Na0.311 O30.366 Pb0.006 Si6 Ti0.018 -","- Al7.272 B3 Ca0.614 F0.633 Fe0.156 H3 Li1.482 Mg0.018 Mn0.057 Na0.311 O30.366 Pb0.006 Si6 Ti0.018 -","- Al21.816 B9 Ca1.842 F1.899 Fe0.468 H9 Li4.446 Mg0.054 Mn0.171 Na0.933 O91.098 Pb0.018 Si18 Ti0.054 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L27, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53","" "9015770","15.856","","15.856","","7.1079","","90","","90","","120","","1547.6","","","","","","","","","","","","pegmatite dikes near Sao Jose da Safira, Minas Gerais, Brazil","12","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.23 B3 Ca0.06 F0.54 Fe0.42 H3.46 Li1.02 Mg0.06 Mn0.18 Na0.73 O30.46 Si6 -","- Al7.23 B3 Ca0.06 F0.54 Fe0.42 H3.46 Li1.02 Mg0.06 Mn0.18 Na0.73 O30.46 Si6 -","- Al21.69 B9 Ca0.18 F1.62 Fe1.26 H10.38 Li3.06 Mg0.18 Mn0.54 Na2.19 O91.38 Si18 -","3","0.166667","","Diego Gatta, G.; Danisi, R. M.; Adamo, I.; Meven, M.; Diella, V.","A single-crystal neutron and X-ray diffraction study of elbaite Note: neutron data","Physics and Chemistry of Minerals","2012","39","","577","588","10.1007/s00269-012-0513-0","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015784","15.9461","","15.9461","","7.138","","90","","90","","120","","1571.87","","","","","","","","","","","","Grotta d'Oggi, San Pietro in Campo, island of Elba, Italy","12","R 3 m :H","R 3 -2""","160","","","Tsilaisite","- Al7.14 B3.06 Ca0.02 F0.41 H6.39 K0.01 Li0.54 Mn1.341 Na0.67 O30.59 Si5.94 Ti0.039 -","- Al7.14 B3.06 Ca0.02 F0.41 H3.39 K0.01 Li0.54 Mn1.341 Na0.67 O30.59 Si5.94 Ti0.039 -","- Al21.42 B9.18 Ca0.06 F1.23 H10.17 K0.03 Li1.62 Mn4.023 Na2.01 O91.77 Si17.82 Ti0.117 -","3","0.166667","","Bosi, F.; Skogby, H.; Agrosì G; Scandale, E.","Tsilaisite, NaMn3Al6(Si6O18)(BO3)3(OH)3OH, a new mineral species of the tourmaline supergroup from Grotta d'Oggi, San Pietro in Campo, island of Elba, Italy Note: this dataset represents the standard tourmaline model","American Mineralogist","2012","97","","989","994","10.2138/am.2012.4019","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07","" "9015796","15.5996","","15.5996","","7.0224","","90","","90","","120","","1479.94","","","","","","","","","","","","Synthetic","6","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.88 B5.22 H Na0.77 O31 Si3.78 -","- Al8.88 B5.22 H1.13 Na0.77 O31.52 Si3.78 -","- Al26.64 B15.66 H3.39 Na2.31 O94.56 Si11.34 -","3","0.166667","","Marler, B.; Borowski, M.; Wodara, U.; Schreyer, W.","Synthetic tourmaline (olenite) with excess boron replacing silicon in the tetrahedral site: II. Structure analysis Sample: 1","European Journal of Mineralogy","2002","14","","763","771","10.1127/0935-1221/2002/0014-0763","","","","","","","","","","","","","","","","","","","","","has coordinates","283912","2023-05-21","08:41:26","" "9015800","16.1121","","16.1121","","7.3701","","90","","90","","120","","1656.95","","","","","","","","","","","","Pereval marble quarry, Sludyanka, Lake Baikal, Russia","11","R 3 m :H","R 3 -2""","160","","","Oxy-chromium-dravite","- Al0.798 B3 Cr5.322 F0.46 H2.67 Mg2.073 Na O30.54 Si5.898 Ti0.039 V0.87 -","- Al0.798 B3 Cr5.322 F0.46 H2.67 Mg2.073 Na O30.54 Si5.898 Ti0.039 V0.87 -","- Al2.394 B9 Cr15.966 F1.38 H8.01 Mg6.219 Na3 O91.62 Si17.694 Ti0.117 V2.61 -","3","0.166667","","Bosi, F.; Reznitskii, L.; Skogby, H.","Oxy-chromium-dravite, NaCr3(Cr4Mg2)(Si6O18)(BO3)3(OH)3O, a new mineral species of the tourmaline supergroup","American Mineralogist","2012","97","","2024","2030","10.2138/am.2012.4210","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9015817","15.8031","","15.8031","","7.0877","","90","","90","","120","","1532.92","","","","","","","","","","","","Eibenstein an der Thaya, Lower Austria","12","R 3 m :H","R 3 -2""","160","","","Rossmanite","- Al8.652 B3.252 Ca0.01 F0.04 Fe0.039 H4.85 Li0.33 Mn0.249 Na0.46 O30.96 Si5.472 Ti0.009 -","- Al8.652 B3.252 Ca0.01 F0.04 Fe0.039 H2.95 Li0.33 Mn0.249 Na0.46 O30.96 Si5.472 Ti0.009 -","- Al25.956 B9.756 Ca0.03 F0.12 Fe0.117 H8.85 Li0.99 Mn0.747 Na1.38 O92.88 Si16.416 Ti0.027 -","3","0.166667","","Ertl, A.; Rossman, G. R.; Hughes, J. M.; Prowatke, S.; Ludwig, T.","Mn-bearing ""oxy-rossmanite"" with tetrahedrally-coordinated Al and B from Austria: Structure, chemistry, and infrared and optical spectroscopic study Sample: REDT1 Reported formula: (Na.46 Ca.01) (Al2.37 Li.33 Mn2+.25 Fe2+.04 Ti4+.01) Al6 (Si5.47 Al.28 B.25) O18 (BO3)3 [(OH)2.85 O.15] [O.86 (OH).10 F.04] Tourmaline","American Mineralogist","2005","90","","481","487","10.2138/am.2005.1683","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07","" "9015827","15.77","","15.77","","7.085","","90","","90","","120","","1525.93","","","","","","","","","","","","Rozna, Moravia, Czech Republic","8","R 3 m :H","R 3 -2""","160","","","Rossmanite","- Al8.16 B3 F0.1 H3.83 Li0.84 Na0.43 O30.9 Si6 -","- Al8.16 B3 F0.1 H3.83 Li0.84 Na0.43 O30.9 Si6 -","- Al24.48 B9 F0.3 H11.49 Li2.52 Na1.29 O92.7 Si18 -","3","0.166667","","Selway, J. B.; Novak, M.; Hawthorne, F. C.; Cerny, P.; Ottolini, L.; Kyser, T. K.","Rossmanite, _(LiAl2)Al6(Si6O18)(BO3)3(OH)4, a new alkali-deficient tourmaline: Description and crystal structure","American Mineralogist","1998","83","","896","900","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51","" "9015848","15.8306","","15.8306","","7.0999","","90","","90","","120","","1540.91","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.239 B3 Ca0.683 F0.639 Fe0.063 H3.36 Li1.632 Mg0.027 Mn0.036 Na0.247 O30.36 Pb0.006 Si6 Ti0.003 -","- Al7.239 B3 Ca0.683 F0.639 Fe0.063 H3 Li1.632 Mg0.027 Mn0.036 Na0.247 O30.36 Pb0.006 Si6 Ti0.003 -","- Al21.717 B9 Ca2.049 F1.917 Fe0.189 H9 Li4.896 Mg0.081 Mn0.108 Na0.741 O91.08 Pb0.018 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L22, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53","" "9015850","15.8438","","15.8438","","7.1043","","90","","90","","120","","1544.44","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.14 B3 Ca0.61 F0.633 Fe0.12 H3.337 Li1.614 Mg0.057 Mn0.06 Na0.322 O30.337 Pb0.007 Si6 Ti0.006 -","- Al7.14 B3 Ca0.61 F0.633 Fe0.12 H3 Li1.614 Mg0.057 Mn0.06 Na0.322 O30.337 Pb0.007 Si6 Ti0.006 -","- Al21.42 B9 Ca1.83 F1.899 Fe0.36 H9 Li4.842 Mg0.171 Mn0.18 Na0.966 O91.011 Pb0.021 Si18 Ti0.018 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L25, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:53","" "9015890","15.8456","","15.8456","","7.1066","","90","","90","","120","","1545.29","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.188 B3 Ca0.628 F0.702 Fe0.021 H5.97 Li1.584 Mn0.207 Na0.297 O32.97 Pb0.023 Si6 -","- Al7.188 B3 Ca0.628 F0.702 Fe0.021 H3 Li1.584 Mn0.207 Na0.297 O32.97 Pb0.023 Si6 -","- Al21.564 B9 Ca1.884 F2.106 Fe0.063 H9 Li4.752 Mn0.621 Na0.891 O98.91 Pb0.069 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L5, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9015903","15.9083","","15.9083","","7.1229","","90","","90","","120","","1561.11","","","","","","","","","","","","Urubu mine, Minas Gerais, Brazil","12","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al7.2 B3 Ca0.02 F0.699 Fe0.909 H6.189 Li0.741 Mn0.09 Na0.83 O30.3 Si6 Zn0.06 -","- Al7.2 B3 Ca0.02 F0.699 Fe0.909 H3.189 Li0.741 Mn0.09 Na0.83 O30.3 Si6 Zn0.06 -","- Al21.6 B9 Ca0.06 F2.097 Fe2.727 H9.567 Li2.223 Mn0.27 Na2.49 O90.9 Si18 Zn0.18 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Skogby, H.; Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.","Fluor-elbaite, Na(Li1.5Al1.5)Al6(Si6O18)(BO3)3(OH)3F, a new mineral species of the tourmaline supergroup Note: split-site SREF","American Mineralogist","2013","98","","297","303","10.2138/am.2013.4285","","","","","","","","","","","","","","","","","","","","","has coordinates","283866","2023-05-18","12:55:07","" "9015912","15.8887","","15.8887","","7.1202","","90","","90","","120","","1556.68","","","","","","","","","","","","Maigen, Moldanubian nappes, Lower Austria","11","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al7.392 B3.042 Ca0.02 F0.81 H3.19 Li0.78 Mn0.651 Na0.84 O30.19 Si5.922 Ti0.009 -","- Al7.392 B3.042 Ca0.02 F0.81 H3.19 Li0.78 Mn0.651 Na0.84 O30.19 Si5.922 Ti0.009 -","- Al22.176 B9.126 Ca0.06 F2.43 H9.57 Li2.34 Mn1.953 Na2.52 O90.57 Si17.766 Ti0.027 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample MAP12","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9015913","15.9107","","15.9107","","7.1267","","90","","90","","120","","1562.42","","","","","","","","","","","","Blocherleitengraben, Moldanubian nappes, Lower Austria","14","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al8.37 B6.06 Ca0.05 F0.79 Fe1.122 H6.03 K0.01 Li1.182 Mn0.96 Na0.89 O42.21 Si5.868 Ti0.078 Zn0.018 -","- Al8.37 B6.06 Ca0.05 F0.79 Fe1.122 H6.03 K0.01 Li1.182 Mn0.96 Na0.89 O42.21 Si5.868 Ti0.078 Zn0.018 -","- Al25.11 B18.18 Ca0.15 F2.37 Fe3.366 H18.09 K0.03 Li3.546 Mn2.88 Na2.67 O126.63 Si17.604 Ti0.234 Zn0.054 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample BLG1","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9015914","14.2418","","14.2418","","30.1143","","90","","90","","120","","5289.73","","","","","","","","","","","","Pocos de Caldas massif, Minas Gerais, Brazil","16","R 3 m :H","R 3 -2""","160","","","Manganoeudialyte","- C2.64 H40.56 Al0.75 Ca18 Ce0.18 F0.39 Fe3.6 K1.17 Mn5.72 Na47.84 Nb0.87 O254.37 Si75.57 Sr2.43 Ti0.57 Zr9.24 -","- C2.64 H38.49 Al0.75 Ca18 Ce0.18 F0.39 Fe3.6 K1.17 Mn4.68 Na45.54 Nb0.87 O254.37 Si75.57 Sr2.43 Ti0.57 Zr9.24 -","- C2.64 H38.49 Al0.75 Ca18 Ce0.18 F0.39 Fe3.6 K1.17 Mn4.68 Na45.54 Nb0.87 O254.37 Si75.57 Sr2.43 Ti0.57 Zr9.24 -","1","0.0555556","","Nomura, S. F.; Atencio, D.; Chukanov, N. V.; Rastsvetaeva, R. K.; Coutinho, J. M. V.; Karipidis, T. K.","Manganoeudialyte - a new mineral from Pocos de Caldas, Minas Gerais, Brazil","Zapiski Rossiiskogo Mineralogicheskogo Obshchetstva","2010","139","","35","47","","","","","","","","","","","","","","","","","","","","","","has coordinates","303136","2025-11-01","12:31:46","" "9015915","15.8286","","15.8286","","7.1012","","90","","90","","120","","1540.8","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.293 B3 Ca0.684 F0.711 Fe0.039 H3.288 Li1.62 Mn0.048 Na0.238 O30.288 Pb0.013 Si6 -","- Al7.293 B3 Ca0.684 F0.711 Fe0.039 H3 Li1.62 Mn0.048 Na0.238 O30.288 Pb0.013 Si6 -","- Al21.879 B9 Ca2.052 F2.133 Fe0.117 H9 Li4.86 Mn0.144 Na0.714 O90.864 Pb0.039 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L24, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9015928","15.8472","","15.8472","","7.0988","","90","","90","","120","","1543.91","","","","","","","","","","","","Koralpe, Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.061 B3.354 Be0.024 Ca0.245 Fe0.669 H3.25 Li0.225 Mg0.039 Mn0.021 Na0.545 O31 Si5.352 Ti0.012 -","- Al8.061 B3.354 Be0.024 Ca0.245 Fe0.669 H3.25 Li0.225 Mg0.039 Mn0.021 Na0.545 O31 Si5.352 Ti0.012 -","- Al24.183 B10.062 Be0.072 Ca0.735 Fe2.007 H9.75 Li0.675 Mg0.117 Mn0.063 Na1.635 O93 Si16.056 Ti0.036 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T4","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9015940","10.675","","10.675","","27.02","","90","","90","","120","","2666.56","","","","","","","","","","","","Hundholmen, Tysfjord, Nordland County, Norway","13","R 3 m :H","R 3 -2""","160","","","Hundholmenite-(Y)","- Al0.66 As0.48 B3 Ca3.15 F11.16 Fe0.27 Mn0.03 Na0.27 O39.64 P0.05 Si6.69 Sm7.71 Y4.38 -","- Al0.66 As0.48 B3 Ca3.15 F11.16 Fe0.27 Mn0.03 Na0.27 O36.64 P0.05 Si6.69 Sm7.71 Y4.38 -","- Al1.98 As1.44 B9 Ca9.45 F33.48 Fe0.81 Mn0.09 Na0.81 O109.92 P0.15 Si20.07 Sm23.13 Y13.14 -","3","0.166667","","Raade, G.; Johnsen, O.; Erambert, M.; Petersen, O. V.","Hundholmenite-(Y) from Norway - a new mineral species in the vicanite group: descriptive data and crystal structure","Mineralogical Magazine","2007","71","","179","192","10.1180/minmag.2007.071.2.179","","","","","","","","","","","","","","","","","","","","","has coordinates","285096","2023-07-08","08:53:35","" "9015956","15.7959","","15.7959","","7.0815","","90","","90","","120","","1530.19","","","","","","","","","","","","Koralpe, Austria","13","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.367 B3.48 Be0.03 Ca0.252 Fe0.336 H3.31 Li0.273 Mg0.012 Mn0.015 Na0.478 O31 Si5.244 Ti0.009 -","- Al8.367 B3.48 Be0.03 Ca0.252 Fe0.336 H3.31 Li0.273 Mg0.012 Mn0.015 Na0.478 O31 Si5.244 Ti0.009 -","- Al25.101 B10.44 Be0.09 Ca0.756 Fe1.008 H9.93 Li0.819 Mg0.036 Mn0.045 Na1.434 O93 Si15.732 Ti0.027 -","3","0.166667","","Hughes, J. M.; Ertl, A.; Dyar, M. D.; Grew, E. S.; Wieden-beck M; Brandstatter, F.","Structural and chemical response to varying B content in zoned Fe-bearing olenite from Koralpe, Austria Sample: T3","American Mineralogist","2004","89","","447","454","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9015987","15.8363","","15.8363","","7.104","","90","","90","","120","","1542.91","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.224 B3 Ca0.636 F0.709 Fe0.045 H3.291 Li1.593 Mg0.003 Mn0.135 Na0.282 O30.291 Pb0.02 Si6 Ti0.003 -","- Al7.224 B3 Ca0.636 F0.709 Fe0.045 H3 Li1.593 Mg0.003 Mn0.135 Na0.282 O30.291 Pb0.02 Si6 Ti0.003 -","- Al21.672 B9 Ca1.908 F2.127 Fe0.135 H9 Li4.779 Mg0.009 Mn0.405 Na0.846 O90.873 Pb0.06 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L7, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9015996","15.8303","","15.8303","","7.1017","","90","","90","","120","","1541.24","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.308 B3 Ca0.691 F0.679 Fe0.054 H3.321 Li1.611 Mg0.003 Mn0.024 Na0.234 O30.321 Pb0.006 Si6 Ti0.003 -","- Al7.308 B3 Ca0.691 F0.679 Fe0.054 H3 Li1.611 Mg0.003 Mn0.024 Na0.234 O30.321 Pb0.006 Si6 Ti0.003 -","- Al21.924 B9 Ca2.073 F2.037 Fe0.162 H9 Li4.833 Mg0.009 Mn0.072 Na0.702 O90.963 Pb0.018 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L20, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016037","15.8299","","15.8299","","7.1009","","90","","90","","120","","1540.99","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.317 B3 Ca0.695 F0.678 Fe0.057 H3.322 Li1.569 Mg0.021 Mn0.033 Na0.24 O30.322 Pb0.007 Si6 Ti0.003 -","- Al7.317 B3 Ca0.695 F0.678 Fe0.057 H3 Li1.569 Mg0.021 Mn0.033 Na0.24 O30.322 Pb0.007 Si6 Ti0.003 -","- Al21.951 B9 Ca2.085 F2.034 Fe0.171 H9 Li4.707 Mg0.063 Mn0.099 Na0.72 O90.966 Pb0.021 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L23, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016060","15.8636","","15.8636","","7.1119","","90","","90","","120","","1549.96","","","","","","","","","","","","Anjanabonoina, central Madagascar","13","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.239 B3 Ca0.487 F0.708 Fe0.111 H3.291 Li1.287 Mn0.363 Na0.435 O30.291 Pb0.022 Si6 Ti0.003 -","- Al7.239 B3 Ca0.487 F0.708 Fe0.111 H3 Li1.287 Mn0.363 Na0.435 O30.291 Pb0.022 Si6 Ti0.003 -","- Al21.717 B9 Ca1.461 F2.124 Fe0.333 H9 Li3.861 Mn1.089 Na1.305 O90.873 Pb0.066 Si18 Ti0.009 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L1, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016083","15.96","","15.96","","7.238","","90","","90","","120","","1596.67","","","","","","","","","","","","Moctezuma, Sonora, Mexico","10","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.47 B3.17 Ca0.18 Fe1.67 H3.6 Mg1.86 Na0.77 O31 Si5.78 Ti0.05 -","- Al5.4702 B3.1698 Ca0.18 Fe1.6701 H3.6 Mg1.8603 Na0.77 O31 Si5.7798 Ti0.0498 -","- Al16.4106 B9.5094 Ca0.54 Fe5.0103 H10.8 Mg5.5809 Na2.31 O93 Si17.3394 Ti0.1494 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Dravite 43167","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:59","" "9016101","15.843","","15.843","","7.1051","","90","","90","","120","","1544.46","","","","","","","","","","","","Blocherleitengraben, Moldanubian nappes, Lower Austria","12","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al9.024 B6.288 Ca0.12 F0.69 Fe0.18 H6.31 Li1.38 Mn0.858 Na0.76 O42.31 Si5.712 Ti0.018 -","- Al9.024 B6.288 Ca0.12 F0.69 Fe0.18 H6.31 Li1.38 Mn0.858 Na0.76 O42.31 Si5.712 Ti0.018 -","- Al27.072 B18.864 Ca0.36 F2.07 Fe0.54 H18.93 Li4.14 Mn2.574 Na2.28 O126.93 Si17.136 Ti0.054 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample BLP1","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016174","16.073","","16.073","","7.306","","90","","90","","120","","1634.57","","","","","","","","","","","","Silver Crater, Hastings Co., Ontario, Canada","11","R 3 m :H","R 3 -2""","160","","","Schorl","- Al3.42 B3 Ca0.01 Fe3.828 H3.6 Mg1.269 Na0.99 O31 Si6 Ti0.402 V0.021 -","- Al3.42 B3 Ca0.01 Fe3.828 H3.6 Mg1.269 Na0.99 O31 Si6 Ti0.402 V0.021 -","- Al10.26 B9 Ca0.03 Fe11.484 H10.8 Mg3.807 Na2.97 O93 Si18 Ti1.206 V0.063 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Schorl 2672","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:10","" "9016176","15.8248","","15.8248","","7.0993","","90","","90","","120","","1539.65","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.257 B3 Ca0.696 F0.668 Fe0.03 H3.332 Li1.68 Mn0.033 Na0.228 O30.332 Pb0.01 Si6 -","- Al7.257 B3 Ca0.696 F0.668 Fe0.03 H3 Li1.68 Mn0.033 Na0.228 O30.332 Pb0.01 Si6 -","- Al21.771 B9 Ca2.088 F2.004 Fe0.09 H9 Li5.04 Mn0.099 Na0.684 O90.996 Pb0.03 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L15, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016209","5.211","","5.211","","18.357","","90","","90","","120","","431.692","","","","","","","","","","","","Khibiny alkaline massif","15","R 3 m :H","R 3 -2""","160","","","Donnayite-(Y)","- C2 H2 Ba0.09 Ca0.19 Ce0.11 Dy0.02 Er0.01 Gd0.02 La0.09 Na0.5 O7 Pr0.01 Sr0.71 Y0.24 Yb0.01 -","- C2.00002 H2.00004 Ba0.09 Ca0.19 Ce0.11 Dy0.02 Er0.01 Gd0.02 La0.09 Na0.5 O7.00002 Pr0.01 Sr0.71 Y0.24 Yb0.01 -","- C6.00006 H6.00012 Ba0.27 Ca0.57 Ce0.33 Dy0.06 Er0.03 Gd0.06 La0.27 Na1.5 O21.0001 Pr0.03 Sr2.13 Y0.72 Yb0.03 -","3","0.166667","","Tjy, C. T. L.; Pobedimskaya, E. A.; Nadezhina, T. N.; Khomyakov, A. P.","Polymorphism of donnayite (Na,TR)Sr(CO3)2*H2O","Moscow University Geology Bulletin","1992","47","","60","70","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:35","" "9016216","15.951","","15.951","","7.138","","90","","90","","120","","1572.83","","","","","","","","","","","","Elba, Italy","8","R 3 m :H","R 3 -2""","160","","","Fluor-tsilaisite","- Al7.767 B3 F0.57 H6 Mn1.233 Na0.666 O30.43 Si6 -","- Al7.767 B3 F0.57 H3 Mn1.233 Na0.666 O30.43 Si6 -","- Al23.301 B9 F1.71 H9 Mn3.699 Na1.998 O91.29 Si18 -","3","0.166667","","Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E.","Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample mnelb3","American Mineralogist","2012","97","","1402","1416","10.2138/am.2012.4028","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016250","15.8248","","15.8248","","7.0993","","90","","90","","120","","1539.65","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.257 B3 Ca0.696 F0.666 Fe0.03 H3.333 Li1.68 Mn0.033 Na0.228 O30.333 Pb0.01 Si6 -","- Al7.257 B3 Ca0.696 F0.666 Fe0.03 H3 Li1.68 Mn0.033 Na0.228 O30.333 Pb0.01 Si6 -","- Al21.771 B9 Ca2.088 F1.998 Fe0.09 H9 Li5.04 Mn0.099 Na0.684 O90.999 Pb0.03 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L15, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016254","16.0393","","16.0393","","7.2536","","90","","90","","120","","1616.05","","","","","","","","","","","","Blocherleitengraben, Lower Austria","9","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al5.295 B3 Ca0.06 F0.3 Fe3.705 H3.23 Na0.94 O30.7 Si6 -","- Al5.295 B3 Ca0.06 F0.3 Fe3.705 H3.23 Na0.94 O30.7 Si6 -","- Al15.885 B9 Ca0.18 F0.9 Fe11.115 H9.69 Na2.82 O92.1 Si18 -","3","0.166667","","Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E.","Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample bls1","American Mineralogist","2012","97","","1402","1416","10.2138/am.2012.4028","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016268","15.852","","15.852","","7.148","","90","","90","","120","","1555.55","","","","","","","","","","","","Elba, Italy","8","R 3 m :H","R 3 -2""","160","","","Fluor-tsilaisite","- Al7.728 B3 F0.14 H6 Mn1.272 Na0.674 O30.86 Si6 -","- Al7.728 B3 F0.14 H3 Mn1.272 Na0.674 O30.86 Si6 -","- Al23.184 B9 F0.42 H9 Mn3.816 Na2.022 O92.58 Si18 -","3","0.166667","","Ertl, A.; Kolitsch, U.; Dyar, M. D.; Hughes, J. M.; Rossman, G. R.; Pieczka, A.; Henry, D. J.; Pezzotta, F.; Prowatke, S.; Lengauer, C. L.; Korner, W.; Brandstatter, F.; Francis, C. A.; Prem, M.; Tillmanns, E.","Limitations of Fe2+ and Mn2+ site occupancy in tourmaline: Evidence from Fe2+ - and Mn2+ -rich tourmaline Note: sample mnelb3h, heated in air at 750 C for 30 h","American Mineralogist","2012","97","","1402","1416","10.2138/am.2012.4028","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016276","15.8418","","15.8418","","7.1044","","90","","90","","120","","1544.07","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.194 B3 Ca0.641 F0.696 Fe0.021 H3.304 Li1.605 Mn0.18 Na0.288 O30.304 Pb0.023 Si6 -","- Al7.194 B3 Ca0.641 F0.696 Fe0.021 H3 Li1.605 Mn0.18 Na0.288 O30.304 Pb0.023 Si6 -","- Al21.582 B9 Ca1.923 F2.088 Fe0.063 H9 Li4.815 Mn0.54 Na0.864 O90.912 Pb0.069 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L6, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016288","14.281","","14.281","","30.243","","90","","90","","120","","5341.62","","","","","","","","","","","","Koashva Mountain, Khibiny massif, Kola Peninsula, Russia","16","R 3 m :H","R 3 -2""","160","","","Andrianovite","- C1.38 H11.58 Ba0.27 Ca17.1 Ce3.06 Cl0.93 Fe6.3 Hf0.18 K4.32 Mn9.3 Na39.02 Nb2.34 O270.63 Si86.85 Sr3.15 Zr8.82 -","- C1.38 H11.58 Ba0.27 Ca17.1 Ce3.06 Cl0.93 Fe5.22 Hf0.18 K4.32 Mn5.58 Na35.1 Nb2.34 O234.63 Si74.85 Sr3.15 Zr8.82 -","- C1.38 H11.58 Ba0.27 Ca17.1 Ce3.06 Cl0.93 Fe5.22 Hf0.18 K4.32 Mn5.58 Na35.1 Nb2.34 O234.63 Si74.85 Sr3.15 Zr8.82 -","1","0.0555556","","Rastsvetaeva, R. K.; Rozenberg, K. A.; Khomyakov, A. P.","Crystal structure of a K analogue of Kentbrooksite","Doklady Chemistry","2005","403","","148","151","10.1007/s10631-005-0058-6","","","","","","","","","","","","","","","","","","","","","has coordinates","285100","2023-07-08","13:37:51","" "9016294","10.7527","","10.7527","","27.4002","","90","","90","","120","","2743.59","","","","","","","","","","","","Tommot REE-Nb deposit in Yakutia, Russia","15","R 3 m :H","R 3 -2""","160","","","Proshchenkoite-(Y)","- As0.04 B3 Ca2.53 F14 Fe0.83 Mn0.93 Na1.17 Nd7.53 O34 P0.7 Pb0.03 Si6.26 Th0.09 Ti0.02 Y3.72 -","- As0.04 B3 Ca2.53 F14 Fe0.83 Mn0.93 Na1.17 Nd7.53 O34 P0.7 Pb0.03 Si6.26 Th0.09 Ti0.02 Y3.72 -","- As0.12 B9 Ca7.59 F42 Fe2.49 Mn2.79 Na3.51 Nd22.59 O102 P2.1 Pb0.09 Si18.78 Th0.27 Ti0.06 Y11.16 -","3","0.166667","","Raade, G.; Grice, J. D.; Erambert, M.; Kristiansson, P.; Witzke, T.","Proshchenkoite-(Y) from Russia - a new mineral species in the vicanite group: Descriptive data and crystal structure","Mineralogical Magazine","2008","72","","1071","1082","10.1180/minmag.2008.072.5.1071","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11","" "9016391","15.935","","15.935","","7.164","","90","","90","","120","","1575.4","","","","","","","","","","","","Noisy Brook gneiss, Roxbury, Oxford County, Maine, USA","13","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.606 B3 Ca0.017 F0.106 Fe1.044 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al6.606 B3 Ca0.017 F0.106 Fe1.044 H3.041 K0.04 Mg1.242 Na0.533 O30.894 Si6 Ti0.084 V0.015 -","- Al19.818 B9 Ca0.051 F0.318 Fe3.132 H9.123 K0.12 Mg3.726 Na1.599 O92.682 Si18 Ti0.252 V0.045 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample Ru-T17-92","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016401","15.965","","15.965","","7.199","","90","","90","","120","","1589.06","","","","","","","","","","","","Tait farm, Dungannon Township, Hastings County, Ontario, Canada","14","R 3 m :H","R 3 -2""","160","","","Fluor-dravite","- Al5.439 B3 Ca0.368 F0.495 Fe1.143 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al5.439 B3 Ca0.368 F0.495 Fe1.143 H3.02 K0.029 Li0.018 Mg2.292 Mn0.012 Na0.471 O30.505 Si6 Ti0.033 -","- Al16.317 B9 Ca1.104 F1.485 Fe3.429 H9.06 K0.087 Li0.054 Mg6.876 Mn0.036 Na1.413 O91.515 Si18 Ti0.099 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample #32008","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016420","15.9466","","15.9466","","7.1384","","90","","90","","120","","1572.06","","","","","","","","","","","","Eibenstein an der Thaya, Lower Austria","12","R 3 m :H","R 3 -2""","160","","","Olenite","- Al7.308 B3 Ca0.011 F0.48 Fe0.021 H3.25 K0.002 Li0.378 Mn1.233 Na0.693 O30.57 Si5.928 -","- Al7.308 B3 Ca0.011 F0.48 Fe0.021 H3.25 K0.002 Li0.378 Mn1.233 Na0.693 O30.57 Si5.928 -","- Al21.924 B9 Ca0.033 F1.44 Fe0.063 H9.75 K0.006 Li1.134 Mn3.699 Na2.079 O91.71 Si17.784 -","3","0.166667","","Ertl, A.; Hughes, J. M.; Prowatke, S.; Rossman, G. R.; London, D.; Fritz, E. A.","Mn-rich tourmaline from Austria: structure, chemistry, optical spectra, and relations to synthetic solid solutions Note: This sample may be named wrong Sample BT","American Mineralogist","2003","88","","1369","1376","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016473","15.934","","15.934","","7.167","","90","","90","","120","","1575.86","","","","","","","","","","","","Small Falls pegmatite, Rumford, Oxford County, Maine, USA","15","R 3 m :H","R 3 -2""","160","","","Fluor-schorl","- Al6.567 B3 Ca0.016 F0.301 Fe1.047 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al6.567 B3 Ca0.016 F0.301 Fe1.047 H3.234 K0.015 Li0.006 Mg1.305 Mn0.018 Na0.684 O30.699 Si6 Ti0.024 V0.006 -","- Al19.701 B9 Ca0.048 F0.903 Fe3.141 H9.702 K0.045 Li0.018 Mg3.915 Mn0.054 Na2.052 O92.097 Si18 Ti0.072 V0.018 -","3","0.166667","","Bloodaxe, E. S.; Hughes, J. M.; Dyar, M. D.; Grew, E. S.; Guidotti, C. V.","Linking structure and chemistry in the schorl-dravite series Sample SmFalls","American Mineralogist","1999","84","","922","928","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016478","15.8933","","15.8933","","7.1222","","90","","90","","120","","1558.02","","","","","","","","","","","","Cruzeiro mine, Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al7.149 B3 Ca0.06 F0.759 Fe0.459 H3.24 K0.01 Li1.02 Mn0.279 Na0.78 O30.24 Si6 Zn0.03 -","- Al7.149 B3 Ca0.06 F0.759 Fe0.459 H3.24 K0.01 Li1.02 Mn0.279 Na0.78 O30.24 Si6 Zn0.03 -","- Al21.447 B9 Ca0.18 F2.277 Fe1.377 H9.72 K0.03 Li3.06 Mn0.837 Na2.34 O90.72 Si18 Zn0.09 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Skogby, H.; Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.","Fluor-elbaite, Na(Li1.5Al1.5)Al6(Si6O18)(BO3)3(OH)3F, a new mineral species of the tourmaline supergroup Note: split-site SREF","American Mineralogist","2013","98","","297","303","10.2138/am.2013.4285","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016494","15.8933","","15.8933","","7.1222","","90","","90","","120","","1558.02","","","","","","","","","","","","Cruzeiro mine, Minas Gerais, Brazil","13","R 3 m :H","R 3 -2""","160","","","Fluor-elbaite","- Al7.149 B3 Ca0.6 F0.76 Fe0.459 H3.24 K0.01 Li1.02 Mn0.279 Na0.78 O30.24 Si6 Zn0.03 -","- Al7.149 B3 Ca0.6 F0.76 Fe0.459 H3.24 K0.01 Li1.02 Mn0.279 Na0.78 O30.24 Si6 Zn0.03 -","- Al21.447 B9 Ca1.8 F2.28 Fe1.377 H9.72 K0.03 Li3.06 Mn0.837 Na2.34 O90.72 Si18 Zn0.09 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Skogby, H.; Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.","Fluor-elbaite, Na(Li1.5Al1.5)Al6(Si6O18)(BO3)3(OH)3F, a new mineral species of the tourmaline supergroup Note: standard SREF","American Mineralogist","2013","98","","297","303","10.2138/am.2013.4285","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016532","15.8171","","15.8171","","7.0935","","90","","90","","120","","1536.9","","","","","","","","","","","","Eibenstein an der Thaya, Lower Austria","12","R 3 m :H","R 3 -2""","160","","","Rossmanite","- Al8.601 B3.24 Ca0.01 F0.04 Fe0.039 H2.899 Li0.321 Mn0.279 Na0.46 O30.96 Si5.508 Ti0.012 -","- Al8.601 B3.24 Ca0.01 F0.04 Fe0.039 H2.899 Li0.321 Mn0.279 Na0.46 O30.96 Si5.508 Ti0.012 -","- Al25.803 B9.72 Ca0.03 F0.12 Fe0.117 H8.697 Li0.963 Mn0.837 Na1.38 O92.88 Si16.524 Ti0.036 -","3","0.166667","","Ertl, A.; Rossman, G. R.; Hughes, J. M.; Prowatke, S.; Ludwig, T.","Mn-bearing ""oxy-rossmanite"" with tetrahedrally-coordinated Al and B from Austria: Structure, chemistry, and infrared and optical spectroscopic study Sample: REDT4 Reported formula: (Na.46 Ca.01) (Al2.35 Li.32 Mn2+.28 Fe2+.04 Ti4+.01) Al6 (Si5.51 Al.25 B.24) O18 (BO3)3 [(OH)2.80 O.20] [O.86 (OH).10 F.04] Tourmaline","American Mineralogist","2005","90","","481","487","10.2138/am.2005.1683","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016536","16.186","","16.186","","7.444","","90","","90","","120","","1688.95","","","","","","","","","","","","San Francisco mine, Villa Tunari, Bolivia","9","R 3 m :H","R 3 -2""","160","","","Povondraite","- Al0.3 B3 Fe6.87 H3.12 K0.2 Mg1.83 Na0.8 O31 Si6 -","- Al0.3 B3 Fe6.87 H3.12 K0.2 Mg1.83 Na0.8 O31 Si6 -","- Al0.9 B9 Fe20.61 H9.36 K0.6 Mg5.49 Na2.4 O93 Si18 -","3","0.166667","","Grice, J. D.; Ercit, T. S.; Hawthorne, F. C.","Povondraite, a redefinition of the tourmaline ferridravite Note: Atomic parameters updated by Grice on 11/20/2001","American Mineralogist","1993","78","","433","436","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016542","15.8675","","15.8675","","7.1135","","90","","90","","120","","1551.07","","","","","","","","","","","","Anjanabonoina, central Madagascar","12","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.167 B3 Ca0.441 F0.681 Fe0.027 H3.319 Li1.278 Mn0.531 Na0.471 O30.319 Pb0.025 Si6 -","- Al7.167 B3 Ca0.441 F0.681 Fe0.027 H3 Li1.278 Mn0.531 Na0.471 O30.319 Pb0.025 Si6 -","- Al21.501 B9 Ca1.323 F2.043 Fe0.081 H9 Li3.834 Mn1.593 Na1.413 O90.957 Pb0.075 Si18 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L11, ordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016583","15.8404","","15.8404","","7.1039","","90","","90","","120","","1543.69","","","","","","","","","","","","Anjanabonoina, central Madagascar","14","R 3 m :H","R 3 -2""","160","","","Fluor-liddicoatite","- Al7.203 B3 Ca0.63 F0.69 Fe0.123 H3.309 Li1.524 Mg0.069 Mn0.069 Na0.338 O30.309 Pb0.007 Si6 Ti0.012 -","- Al7.203 B3 Ca0.63 F0.69 Fe0.123 H3 Li1.524 Mg0.069 Mn0.069 Na0.338 O30.309 Pb0.007 Si6 Ti0.012 -","- Al21.609 B9 Ca1.89 F2.07 Fe0.369 H9 Li4.572 Mg0.207 Mn0.207 Na1.014 O90.927 Pb0.021 Si18 Ti0.036 -","3","0.166667","","Lussier, A. J.; Abdu, Y.; Hawthorne, F. C.; Michaelis, V. K.; Aguiar, P. M.; Kroeker, S.","Oscillatory zoned liddicoatite from Anjanabonoina, central Madigascar. I. Crystal chemistry and structure by SREF and 11B and 27Al MAS NMR spectroscopy Sample: L28, disordered model","The Canadian Mineralogist","2011","49","","63","88","10.3749/canmin.49.1.63","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:54","" "9016586","15.99","","15.99","","7.195","","90","","90","","120","","1593.16","","","","","","","","","","","","York River, Hastings Co., Ontario, Canada","11","R 3 m :H","R 3 -2""","160","","","Shorl","- Al6.24 B3.09 F0.19 Fe1.939 H3.41 Li0.021 Mg0.7 Na0.96 O30.81 Si5.802 Ti0.208 -","- Al6.24 B3.09 F0.19 Fe1.9392 H3.41 Li0.021 Mg0.6996 Na0.96 O30.81 Si5.802 Ti0.2082 -","- Al18.72 B9.27 F0.57 Fe5.8176 H10.23 Li0.063 Mg2.0988 Na2.88 O92.43 Si17.406 Ti0.6246 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Shorl 49356","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46","" "9016636","15.7395","","15.7395","","7.0656","","90","","90","","120","","1515.87","","","","","","","","","","","","Koralpe, Styria, Austria","9","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.262 B3.762 Ca0.3 F0.15 H5.7 Li0.738 Na0.42 O30.85 Si5.238 -","- Al8.262 B3.762 Ca0.3 F0.15 H5.7 Li0.738 Na0.42 O30.85 Si5.238 -","- Al24.786 B11.286 Ca0.9 F0.45 H17.1 Li2.214 Na1.26 O92.55 Si15.714 -","3","0.166667","","Ertl, A.; Pertlik, F.; Bernhardt, H. J.","Investigations on olenite with exess boron from Koralpe, Styria, Austria","Anzeiger der Osterreichische Akademie der Wissenschaften","1997","134","","3","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11","" "9016653","16.186","","16.186","","7.444","","90","","90","","120","","1688.95","","","","","","","","","","","","San Francisco mine, Villa Tu nari, Bolivia","10","R 3 m :H","R 3 -2""","160","","","Povondraite","- Al0.32 B3.06 Fe6.82 H3.3 K0.26 Mg1.85 Na0.79 O31 Si5.94 V0.01 -","- Al0.3198 B3.06 Fe6.8202 H3.3 K0.26 Mg1.8501 Na0.79 O31 Si5.94 V0.0099 -","- Al0.9594 B9.18 Fe20.4606 H9.9 K0.78 Mg5.5503 Na2.37 O93 Si17.82 V0.0297 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Povondraite 144478","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:47:59","" "9016720","15.999","","15.999","","7.236","","90","","90","","120","","1604.04","","","","","","","","","","","","Pierrepont, St, Lawrence Co., New York, USA","11","R 3 m :H","R 3 -2""","160","","","Fluor-dravite","- Al5.29 B3 Ca0.301 F0.42 Fe H3.28 Mg2.7 Na0.713 O30.58 Si5.94 Ti0.06 -","- Al5.2902 B3 Ca0.301 F0.42 Fe1.0002 H3.28 Mg2.7 Na0.713 O30.58 Si5.94 Ti0.06 -","- Al15.8706 B9 Ca0.903 F1.26 Fe3.0006 H9.84 Mg8.1 Na2.139 O91.74 Si17.82 Ti0.18 -","3","0.166667","","Grice, J. D.; Ercit, T. S.","Ordering of Fe and Mg in the tourmaline crystal structure: The correct formula Sample: Dravite 43873","Neues Jahrbuch fur Mineralogie, Abhandlungen","1993","165","","245","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46","" "9016721","15.9783","","15.9783","","7.1507","","90","","90","","120","","1581.03","","","","","","","","","","","","Maigen, Moldanubian nappes, Lower Austria","15","R 3 m :H","R 3 -2""","160","","","Schorl","- Al7.872 B3 Ca0.01 F0.26 Fe3.258 H3.74 K0.01 Li0.06 Mg0.318 Mn0.222 Na0.61 O39.74 Si5.652 Ti0.24 Zn0.078 -","- Al7.872 B3 Ca0.01 F0.26 Fe3.258 H3.74 K0.01 Li0.06 Mg0.318 Mn0.222 Na0.61 O39.74 Si5.652 Ti0.24 Zn0.078 -","- Al23.616 B9 Ca0.03 F0.78 Fe9.774 H11.22 K0.03 Li0.18 Mg0.954 Mn0.666 Na1.83 O119.22 Si16.956 Ti0.72 Zn0.234 -","3","0.166667","","Ertl, A.; Schuster, R.; Hughes, J. M.; Ludwig, T.; Meyer, H.-P.; Finger, F.; Dyar, M. D.; Ruschel, K.; Rossman, G. R.; Klotzli, U.; Brandstatter, F.; Lengauer, C. L.; Tillmanns, E.","Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample MASR","European Journal of Mineralogy","2012","24","","695","715","10.1127/0935-1221/2012/0024-2203","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016766","15.947","","15.947","","7.214","","90","","90","","120","","1588.78","","","","","","","","","","","","Osarar, Narok District, Kenya","13","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.078 B3 Ca0.009 Cr0.006 Fe0.612 H4 K0.014 Mg2.274 Mn0.003 Na0.814 O34 Si6 Ti0.03 -","- Al6.078 B3 Ca0.009 Cr0.006 Fe0.612 H4 K0.014 Mg2.274 Mn0.003 Na0.814 O34 Si6 Ti0.03 -","- Al18.234 B9 Ca0.027 Cr0.018 Fe1.836 H12 K0.042 Mg6.822 Mn0.009 Na2.442 O102 Si18 Ti0.09 -","3","0.166667","","Hawthorne, F. C.; MacDonald, D. J.; Burns, P. C.","Reassignment of cation site occupancies in tourmaline: Al-Mg disorder in the crystal structure of dravite","American Mineralogist","1993","78","","265","270","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016906","15.916","","15.916","","7.1071","","90","","90","","120","","1559.16","","","","","","","","","","","","Zlata Idka, Slovak Republic","10","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al7.807 B3 Ca0.103 Fe1.108 Mg0.572 Mn0.005 Na0.591 O31 Si5.506 Ti0.002 -","- Al7.8069 B3 Ca0.103 Fe1.1079 Mg0.5718 Mn0.0051 Na0.591 O31 Si5.5062 Ti0.0021 -","- Al23.4207 B9 Ca0.309 Fe3.3237 Mg1.7154 Mn0.0153 Na1.773 O93 Si16.5186 Ti0.0063 -","3","0.166667","","Bacik, P.; Cempirek, J.; Uher, P.; Novak, M.; Ozdin, D.; Filip, J.; Skoda, R.; Breiter, K.; Klementova, M.; Duda, R.; Groat, L. A.","Oxy-schorl, Na(Fe2+2Al)Al6Si6O18(BO3)3(OH)3O, a new mineral from Zlata Idka, Slovak Republic and Pribyslavice, Czech Republic","American Mineralogist","2013","98","","485","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:55","" "9016907","15.9853","","15.9853","","7.1538","","90","","90","","120","","1583.1","","","","","","","","","","","","Pribyslavice, Czech Republic","13","R 3 m :H","R 3 -2""","160","","","Oxy-schorl","- Al6.801 B3 Ca0.017 F0.307 Fe1.957 H6.115 K0.006 Mg0.19 Mn0.015 Na0.586 O30.694 Si5.944 Ti0.093 -","- Al6.8007 B3 Ca0.017 F0.307 Fe1.9569 H3.115 K0.006 Mg0.1902 Mn0.015 Na0.586 O30.694 Si5.9442 Ti0.093 -","- Al20.4021 B9 Ca0.051 F0.921 Fe5.8707 H9.345 K0.018 Mg0.5706 Mn0.045 Na1.758 O92.082 Si17.8326 Ti0.279 -","3","0.166667","","Bacik, P.; Cempirek, J.; Uher, P.; Novak, M.; Ozdin, D.; Filip, J.; Skoda, R.; Breiter, K.; Klementova, M.; Duda, R.; Groat, L. A.","Oxy-schorl, Na(Fe2+2Al)Al6Si6O18(BO3)3(OH)3O, a new mineral from Zlata Idka, Slovak Republic and Pribyslavice, Czech Republic","American Mineralogist","2013","98","","485","492","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46","" "9016908","16.1908","","16.1908","","7.4143","","90","","90","","120","","1683.21","","","","","","","","","","","","Sludyanka complex, southern Baikal region, Russia","7","R 3 m :H","R 3 -2""","160","","","Oxy-vanadium-dravite","- B3 H3 Mg2.586 Na O31 Si6 V6.189 -","- B3 H3 Mg2.586 Na1.029 O31 Si6 V6.189 -","- B9 H9 Mg7.758 Na3.087 O93 Si18 V18.567 -","3","0.166667","","Bosi, F.; Reznitskii, L.; Sklyarov, E. V.","Oxy-vanadium-dravite, NaV3(V4Mg2)(Si6O18)(BO3)3(OH)3O: Crystal structure and redefinition of the ""vanadium-dravite"" tourmaline","American Mineralogist","2013","98","","501","505","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:48:00","" "9016941","15.9273","","15.9273","","7.2001","","90","","90","","120","","1581.81","","","","","","","","","","","","Osarara, Narok district, Kenya","10","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al6.291 B3 Fe0.627 H3.24 K0.02 Mg2.061 Na0.83 O31 Si6 Ti0.021 -","- Al6.291 B3 Fe0.627 H3.24 K0.02 Mg2.061 Na0.83 O31 Si6 Ti0.021 -","- Al18.873 B9 Fe1.881 H9.72 K0.06 Mg6.183 Na2.49 O93 Si18 Ti0.063 -","3","0.166667","","Bosi, F.; Skogby, H.","Oxy-dravite, Na(Al2Mg)(Al5Mg)(Si6O18)(BO3)3(OH)3O, a new mineral species of the tourmaline supergroup","American Mineralogist","2013","98","","1442","1448","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016946","16.0032","","16.0032","","7.2823","","90","","90","","120","","1615.15","","","","","","","","","","","","Sludyanka crystalline complex, Lake Baikal, Russia","14","R 3 m :H","R 3 -2""","160","","","Chromo-alumino-povondraite","- Al3.807 B3 Ca0.19 Cr2.103 F0.23 Fe0.468 H3.08 K0.02 Mg2.412 Na0.76 O30.77 Si6 Ti0.06 V0.192 -","- Al3.807 B3 Ca0.19 Cr2.103 F0.23 Fe0.468 H3.08 K0.02 Mg2.412 Na0.76 O30.77 Si6 Ti0.06 V0.192 -","- Al11.421 B9 Ca0.57 Cr6.309 F0.69 Fe1.404 H9.24 K0.06 Mg7.236 Na2.28 O92.31 Si18 Ti0.18 V0.576 -","3","0.166667","","Bosi, F.; Skogby, H.; Halenius, U.; Reznitskii, L.","Crystallographic and spectroscopic characterization of Fe-bearing chromo-alumino-povondraite and its relations with oxy-chromium-dravite and oxy-dravite","American Mineralogist","2013","98","","1557","1564","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:52","" "9016955","15.84","","15.84","","7.091","","90","","90","","120","","1540.81","","","","","","","","","","","","Synthetic","7","R 3 m :H","R 3 -2""","160","","","Olenite","- Al8.34 B3 Cu1.26 H3 Na0.86 O31 Si5.4 -","- Al8.34 B3 Cu1.26 H3 Na0.86 O31 Si5.4 -","- Al25.02 B9 Cu3.78 H9 Na2.58 O93 Si16.2 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Mashkovtsev, R. I.","Crystal chemistry of Cu-bearing tourmalines Note: Sample 1","American Mineralogist","2013","98","","1610","1616","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:55","" "9016956","15.881","","15.881","","7.112","","90","","90","","120","","1553.38","","","","","","","","","","","","Paraiba, Brazil","13","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.65 B3 Ca0.03 Cu0.348 F0.06 Fe0.03 H6 Li0.75 Mn0.18 Na0.9 O30.8 Si5.7 Zn0.342 -","- Al7.65 B3 Ca0.03 Cu0.348 F0.06 Fe0.03 H6 Li0.75 Mn0.18 Na0.9 O30.8 Si5.7 Zn0.342 -","- Al22.95 B9 Ca0.09 Cu1.044 F0.18 Fe0.09 H18 Li2.25 Mn0.54 Na2.7 O92.4 Si17.1 Zn1.026 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Mashkovtsev, R. I.","Crystal chemistry of Cu-bearing tourmalines Note: Sample 2","American Mineralogist","2013","98","","1610","1616","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:55","" "9016957","15.84","","15.84","","7.1028","","90","","90","","120","","1543.37","","","","","","","","","","","","Paraiba, Brazil","11","R 3 m :H","R 3 -2""","160","","","Elbaite","- Al7.74 B3 Ca0.09 Cu0.18 F0.06 H3 Li1.08 Mn0.3 Na0.65 O30.82 Si5.7 -","- Al7.74 B3 Ca0.09 Cu0.18 F0.06 H3 Li1.08 Mn0.3 Na0.65 O30.82 Si5.7 -","- Al23.22 B9 Ca0.27 Cu0.54 F0.18 H9 Li3.24 Mn0.9 Na1.95 O92.46 Si17.1 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.; Mashkovtsev, R. I.","Crystal chemistry of Cu-bearing tourmalines Note: Sample 3","American Mineralogist","2013","98","","1610","1616","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:55","" "9016959","15.809","","15.809","","7.089","","90","","90","","120","","1534.35","","","","","","","","","","","","Nova Ves near Cesky Krumlov, southern Bohemia, Moldanubian Zone, Czech Republic","8","R 3 m :H","R 3 -2""","160","","","Darrellhenryite","- Al7.953 B3 F0.34 H3 Li1.047 Na0.561 O30.66 Si6 -","- Al7.953 B3 F0.34 H3 Li1.047 Na0.561 O30.66 Si6 -","- Al23.859 B9 F1.02 H9 Li3.141 Na1.683 O91.98 Si18 -","3","0.166667","","Novak, M.; Ertl, A.; Povondra, P.; Galiova, M. V.; Rossman, G. R.; Pristacz, H.; Prem, M.; Giester, G.; Gadas, P.; Skoda, R.","Darrellhenryite, Na(LiAl2)Al6(BO3)3Si6O18(OH)3O, a new mineral from the tourmaline supergroup","American Mineralogist","2013","98","","1886","1892","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:55","" "9017023","16.0273","","16.0273","","7.2833","","90","","90","","120","","1620.24","","","","","","","","","","","","Sludyanka, Lake Baikal, Russia","10","R 3 m :H","R 3 -2""","160","","","Vanadio-oxy-dravite","- Al4.14 B3 Ca0.207 Cr0.18 H3 Mg2.4 Na0.793 O31 Si6 V2.253 -","- Al4.14 B3 Ca0.207 Cr0.18 H3 Mg2.4 Na0.793 O31 Si6 V2.253 -","- Al12.42 B9 Ca0.621 Cr0.54 H9 Mg7.2 Na2.379 O93 Si18 V6.759 -","3","0.166667","","Bosi, F.; Skogby, H.; Reznitskii, L.; Halenius, U.","Vanadio-oxy-dravite, NaV3(Al4Mg2)(Si6O18)(BO3)3(OH)3O, a new mineral species of the tourmaline supergroup","American Mineralogist","2014","99","","218","224","","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:11","" "9017074","16.0277","","16.0277","","7.3085","","90","","90","","120","","1625.93","","","","","","","","","","","","Sludyanka, Lake Baikal, Russia","13","R 3 m :H","R 3 -2""","160","","","Chromo-alumino-povondraite","- Al3.08 B3 Ca0.07 Cr3.47 F0.25 Fe0.01 H3.02 K0.02 Mg2.25 Na0.87 O30.75 Si5.96 V0.22 -","- Al3.08004 B3 Ca0.07 Cr3.47001 F0.25 Fe0.01002 H3.02 K0.02 Mg2.25003 Na0.87 O30.75 Si5.95998 V0.22002 -","- Al9.24012 B9 Ca0.21 Cr10.41 F0.75 Fe0.03006 H9.06 K0.06 Mg6.75009 Na2.61 O92.25 Si17.8799 V0.66006 -","3","0.166667","","Reznitskii, L.; Clark, C. M.; Hawthorne, F. C.; Grice, J. D.; Skogby, H.; Halenius, U.; Bosi, F.","Chromo-alumino-povondraite, NaCr3(Al4Mg2)(Si6O18)(BO3)3(OH)3O, a new mineral species of the tourmaline supergroup","American Mineralogist","2014","99","","1767","1773","","","","","","","","","","","","","","","","","","","","","","has coordinates","285095","2023-07-08","07:48:16","" "9017192","16.0047","","16.0047","","7.212","","90","","90","","120","","1599.86","","","","","","","","","","","","Mirosov, Moldanubian zone, Czech Republic","9","R 3 m :H","R 3 -2""","160","","","Feruvite","- Al5.688 B3 Ca0.424 Fe2.517 H7 Mg0.795 Na0.576 O31 Si6 -","- Al5.688 B3 Ca0.424 Fe2.517 H4 Mg0.795 Na0.576 O31 Si6 -","- Al17.064 B9 Ca1.272 Fe7.551 H12 Mg2.385 Na1.728 O93 Si18 -","3","0.166667","","Gadas, P.; Novak, M.; Cempirek, J.; Filip, J.; Galiova, M. V.; Groat, L. A.; Vsiansky, D.","Mineral assemblages, compositional variation, and crystal structure of feruvitic tourmaline from a contaminated anatectic pegmatite at Mirosov near Strazek, Moldanubian zone, Czech Republic Note: site occupancies from typical X-ray diffraction analysis","The Canadian Mineralogist","2014","52","","285","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56","" "9017193","16.0047","","16.0047","","7.212","","90","","90","","120","","1599.86","","","","","","","","","","","","Mirosov, Moldanubian zone, Czech Republic","13","R 3 m :H","R 3 -2""","160","","","Feruvite","- Al5.592 B3 Ca0.494 F0.06 Fe2.472 H4.648 Mg0.939 Mn0.03 Na0.451 O30.94 Si5.88 Ti0.084 Zn0.006 -","- Al5.592 B3 Ca0.494 F0.06 Fe2.472 H2.656 Mg0.939 Mn0.03 Na0.451 O30.94 Si5.88 Ti0.084 Zn0.006 -","- Al16.776 B9 Ca1.482 F0.18 Fe7.416 H7.968 Mg2.817 Mn0.09 Na1.353 O92.82 Si17.64 Ti0.252 Zn0.018 -","3","0.166667","","Gadas, P.; Novak, M.; Cempirek, J.; Filip, J.; Galiova, M. V.; Groat, L. A.; Vsiansky, D.","Mineral assemblages, compositional variation, and crystal structure of feruvitic tourmaline from a contaminated anatectic pegmatite at Mirosov near Strazek, Moldanubian zone, Czech Republic Note: site occupancies from electron density approximation","The Canadian Mineralogist","2014","52","","285","301","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56","" "9017234","15.926","","15.926","","7.21","","90","","90","","120","","1583.72","","","","","","","","","","","","Shabrovskoe ore district, Middle Urals, Russia","10","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.7 B3 Ca0.06 Cr0.72 Fe0.18 H3.96 Mg2.52 Na0.64 O31 Si5.88 -","- Al5.7 B3 Ca0.06 Cr0.72 Fe0.18 H3.96 Mg2.52 Na0.64 O31 Si5.88 -","- Al17.1 B9 Ca0.18 Cr2.16 Fe0.54 H11.88 Mg7.56 Na1.92 O93 Si17.64 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.","Ion substitutions and structural adjustment in Cr-bearing tourmalines Note: Sample 1","European Journal of Mineralogy","2014","26","","309","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","283861","2023-05-18","12:40:59","" "9017235","15.933","","15.933","","7.213","","90","","90","","120","","1585.78","","","","","","","","","","","","Shabrovskoe ore district, Middle Urals, Russia","11","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.91 B3 Ca0.02 Cr0.72 Fe0.09 H3.68 K0.01 Mg2.34 Na0.76 O31 Si5.94 -","- Al5.91 B3 Ca0.02 Cr0.72 Fe0.09 H3.68 K0.01 Mg2.34 Na0.76 O31 Si5.94 -","- Al17.73 B9 Ca0.06 Cr2.16 Fe0.27 H11.04 K0.03 Mg7.02 Na2.28 O93 Si17.82 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.","Ion substitutions and structural adjustment in Cr-bearing tourmalines Note: Sample 2","European Journal of Mineralogy","2014","26","","309","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","283862","2023-05-18","12:42:19","" "9017236","15.933","","15.933","","7.213","","90","","90","","120","","1585.78","","","","","","","","","","","","Shabrovskoe ore district, Middle Urals, Russia","10","R 3 m :H","R 3 -2""","160","","","Dravite","- Al5.85 B3 Ca0.13 Cr0.81 Fe0.09 H3.4 Mg2.25 Na0.63 O31 Si6 -","- Al5.85 B3 Ca0.13 Cr0.81 Fe0.09 H3.4 Mg2.25 Na0.63 O31 Si6 -","- Al17.55 B9 Ca0.39 Cr2.43 Fe0.27 H10.2 Mg6.75 Na1.89 O93 Si18 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.","Ion substitutions and structural adjustment in Cr-bearing tourmalines Note: Sample 3","European Journal of Mineralogy","2014","26","","309","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","283863","2023-05-18","12:44:48","" "9017237","15.921","","15.921","","7.194","","90","","90","","120","","1579.22","","","","","","","","","","","","Umba Valley, Tanzania","9","R 3 m :H","R 3 -2""","160","","","Dravite","- Al6.15 B3 Ca0.41 Cr0.18 H3.56 Mg2.79 Na0.43 O31 Si5.88 -","- Al6.15 B3 Ca0.41 Cr0.18 H3.56 Mg2.79 Na0.43 O31 Si5.88 -","- Al18.45 B9 Ca1.23 Cr0.54 H10.68 Mg8.37 Na1.29 O93 Si17.64 -","3","0.166667","","Vereshchagin, O. S.; Rozhdestvenskaya, I. V.; Frank-Kamenetskaya O V; Zolotarev, A. A.","Ion substitutions and structural adjustment in Cr-bearing tourmalines Note: Sample 4","European Journal of Mineralogy","2014","26","","309","321","","","","","","","","","","","","","","","","","","","","","","has coordinates","283863","2023-05-18","12:44:49","" "9017460","14.2956","","14.2956","","30.0228","","90","","90","","120","","5313.57","","","","","","","","","","","","Khibiny alkaline massif, Russia","15","R 3 m :H","R 3 -2""","160","","","Davinciite","- Ba0.03 Ca6 Cl1.62 Fe2.25 H1.662 Hf0.03 K2.295 Mn0.15 Na12.945 Nb0.03 O74.389 Si26 Sr0.3 Ti0.15 Zr2.79 -","- Ba0.03 Ca6 Cl1.62 Fe2.25 H1.662 Hf0.03 K2.295 Mn0.15 Na12.945 Nb0.03 O74.389 Si26 Sr0.3 Ti0.15 Zr2.79 -","- Ba0.09 Ca18 Cl4.86 Fe6.75 H4.986 Hf0.09 K6.885 Mn0.45 Na38.835 Nb0.09 O223.167 Si78 Sr0.9 Ti0.45 Zr8.37 -","3","0.166667","","Rastsvetaeva, R. K.; Rozenberg, K. A.; Khomyakov, A. P.","Crystal structure of high-silica K,Na-ordered acentric eudialyte analogue","Doklady Chemistry","2009","424","","11","14","","","","","","","","","","","","","","","","","","","","","","has coordinates","294031","2024-08-07","17:26:35","" "9017504","15.929","","15.929","","7.183","","90","","90","","120","","1578.39","","","","","","","","","","","","Kiura mine, Saiki City, Oita Prefecture, Japan","10","R 3 m :H","R 3 -2""","160","","","Adachiite","- Al7.47 B3 Ca0.62 Fe1.72 H4 Mg0.6 Na0.28 O31 Si5.15 Ti0.06 -","- Al7.47 B3 Ca0.62 Fe1.71999 H4 Mg0.60003 Na0.28 O31 Si5.14998 Ti0.06 -","- Al22.41 B9 Ca1.86 Fe5.15997 H12 Mg1.80009 Na0.84 O93 Si15.4499 Ti0.18 -","3","0.166667","","Nishio-Hamane D; Minakawa, T.; Yamaura, J.; Oyama, T.; Ohnishi, M.; Shimobayashi, N.","Adachiite, a Si-poor member of the tourmaline supergroup from the Kiura mine, Oita Prefecture, Japan","Journal of Mineralogical and Petrological Sciences","2014","109","","74","78","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56","" "9017660","15.9272","","15.9272","","7.2001","","90","","90","","120","","1581.79","","","","","","","","","","","","Osarara, Narok District, Kenya","8","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al6.624 B3 Fe0.6 H3.194 Mg1.776 Na0.866 O31 Si6 -","- Al6.624 B3 Fe0.6 H3.194 Mg1.776 Na0.866 O31.024 Si6 -","- Al19.872 B9 Fe1.8 H9.582 Mg5.328 Na2.598 O93.072 Si18 -","3","0.166667","","Gatta, G. D.; Bosi, F.; McIntyre, G. J.; Skogby, H.","First accurate location of two proton sites in tourmaline: A single-crystal neutron diffraction study of oxy-dravite Note: H1 site on the three-fold axis","Mineralogical Magazine","2014","78","","681","692","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56","" "9017661","15.9272","","15.9272","","7.2001","","90","","90","","120","","1581.79","","","","","","","","","","","","Osarara, Narok District, Kenya","8","R 3 m :H","R 3 -2""","160","","","Oxy-dravite","- Al6.537 B3 Fe0.6 H3.165 Mg1.863 Na0.873 O31 Si6 -","- Al6.537 B3 Fe0.6 H3.165 Mg1.863 Na0.873 O31.039 Si6 -","- Al19.611 B9 Fe1.8 H9.495 Mg5.589 Na2.619 O93.117 Si18 -","3","0.166667","","Gatta, G. D.; Bosi, F.; McIntyre, G. J.; Skogby, H.","First accurate location of two proton sites in tourmaline: A single-crystal neutron diffraction study of oxy-dravite Note: H1 site off the three-fold axis","Mineralogical Magazine","2014","78","","681","692","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56","" "9017690","15.9619","","15.9691","","7.1426","","90","","90","","120","","1576.71","","","","","","","","","","","","Grotta d'Oggi, San Piero in Campo, Elba Island, Italy","13","R 3 m :H","R 3 -2""","160","","","Fluor-tsilaisite","- Al21.186 B9 Ca0.043 F1.039 Fe0.081 H17 K0.014 Li0.917 Mn4.887 Na1.842 O91.961 Si17.811 Ti0.123 -","- Al21.186 B9 Ca0.0429 F1.0389 Fe0.081 H9 K0.0138 Li0.9171 Mn4.887 Na1.842 O91.9611 Si17.811 Ti0.1233 -","- Al21.186 B9 Ca0.0429 F1.0389 Fe0.081 H9 K0.0138 Li0.9171 Mn4.887 Na1.842 O91.9611 Si17.811 Ti0.1233 -","1","0.0555556","","Bosi, F.; Andreozzi, G. B.; Agrosi, G.; Scandale, E.","Fluor-tsilaisite, NaMn3Al6(Si6O18)(BO3)3(OH)3F, a new tourmaline from San Piero in Campo (Elba, Italy) and new data on tsilaisitic tourmaline from the holotype specimen locality Note: Sample CB1b, Standard SREF","Mineralogical Magazine","2015","79","","89","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56","" "9017691","15.9619","","15.9691","","7.1426","","90","","90","","120","","1576.71","","","","","","","","","","","","Grotta d'Oggi, San Piero in Campo, Elba Island, Italy","13","R 3 m :H","R 3 -2""","160","","","Fluor-tsilaisite","- Al7.038 B3 Ca0.014 F0.346 Fe0.027 H3 K0.005 Li0.306 Mn1.653 Na0.609 O30.654 Si5.937 Ti0.041 -","- Al7.038 B3 Ca0.0143 F0.3462 Fe0.027 H3 K0.0046 Li0.3057 Mn1.653 Na0.609 O30.6537 Si5.937 Ti0.0411 -","- Al21.114 B9 Ca0.0429 F1.0386 Fe0.081 H9 K0.0138 Li0.9171 Mn4.959 Na1.827 O91.9611 Si17.811 Ti0.1233 -","3","0.166667","","Bosi, F.; Andreozzi, G. B.; Agrosi, G.; Scandale, E.","Fluor-tsilaisite, NaMn3Al6(Si6O18)(BO3)3(OH)3F, a new tourmaline from San Piero in Campo (Elba, Italy) and new data on tsilaisitic tourmaline from the holotype specimen locality Note: Sample CB1b, Split-site SREF","Mineralogical Magazine","2015","79","","89","101","","","","","","","","","","","","","","","","","","","","","","has coordinates","292100","2024-05-29","14:19:56",""