# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-05-17T12:44:57+02:00
# Query:
# SELECT data.*
# FROM
#  data 
# WHERE
#  (status is null or status != 'retracted') and
#  (sg LIKE 'P 63 m c' 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
"1000115","12.872","0.001","12.872","0.001","4.9772","0.0004","90","","90","","120","","714.2","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Zinc octakis(hydrogenphosphate(III)) hexahydroxide","","- H14 O30 P8 Zn11 -","- H20 O30 P8 Zn11.0004 -","- H20 O30 P8 Zn11.0004 -","1","0.0833333","","Marcos, M D; Amoros, P; Le Bail, A","Synthesis and crystal structure of a tubular hydroxyphosphite: Zn~11~(HPO~3~)~8~(OH)~6~","Journal of Solid State Chemistry","1993","107","","250","257","10.1006/jssc.1993.1345","","","","","","0.03","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000155","5.409","0.002","5.409","0.002","8.6","0.001","90","","90","","120","","217.9","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lanthanum nickel deuteride (1/5/7)","","- D7 La Ni5 -","- D7 La Ni5 -","- D14 La2 Ni10 -","2","0.166667","","Lartigue, C; Le Bail, A; Percheron Guegan, A","A new study of the structure of La Ni5 D6.7 using a modified Rietveld method for the refinement of neutron powder diffraction data","Journal of the Less-Common Metals","1987","129","","65","76","10.1016/0022-5088(87)90034-8","","","","","","0.081","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000156","5.409","0.002","5.409","0.002","8.6","0.001","90","","90","","120","","217.9","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lanthanum nickel deuteride (1/5/7)","","- D7 La Ni5 -","- D7 La Ni5 -","- D14 La2 Ni10 -","2","0.166667","","Lartigue, C; Le Bail, A; Percheron Guegan, A","A new study of the structure of La Ni5 D6.7 using a modified Rietveld method for the refinement of neutron powder diffraction data","Journal of the Less-Common Metals","1987","129","","65","76","10.1016/0022-5088(87)90034-8","","","","","","0.0718","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000196","5.95","0.002","5.95","0.002","9.701","0.004","90","","90","","120","","297.4","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Lithium iron(III) antimony(V) tin(IV) oxide (4.66/4/2/1.32/16) - Low form","","- Fe4 Li4.66 O16 Sb2 Sn1.32 -","- Fe4 Li4.66 O16 Sb2.0122 Sn1.3278 -","- Fe4 Li4.66 O16 Sb2.0122 Sn1.3278 -","1","0.0833333","","Lacorre, P; Hervieu, M; Choisnet, J; Raveau, B","Oxydes M~3~ O~4~ a empilement hexagonal double type D.H. Li Fe Sn O~4~ (M = Li,Fe,Sb,Sn): Transitions reversibles ramsdellite - D.H. Li Fe Sn O~4~","Journal of Solid State Chemistry","1984","51","","44","52","10.1016/0022-4596(84)90313-X","","","","","","0.04","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1000434","6.012","0.001","6.012","0.001","9.776","0.002","90","","90","","120","","306","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Lithium iron(III) tin(IV) oxide - DH","","- Fe Li O4 Sn -","- Fe Li1.00005 O4 Sn0.99995 -","- Fe4 Li4.0002 O16 Sn3.9998 -","4","0.333333","","Lacorre, P; Hervieu, M; Pannetier, J; Choisnet, J; Raveau, B","Neutron diffraction study of Li1+x (Li2x/3 Fe1-x Sn1+x/3) O4, a nonstoichiometric ramsdellite and its transition to a double hexagonal close packed structure for x = 0","Journal of Solid State Chemistry","1983","50","","196","203","10.1016/0022-4596(83)90188-3","","","","","","0.019","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001220","6.012","0.001","6.012","0.001","9.776","0.002","90","","90","","120","","306","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Lithium iron(III) tin(IV) oxide - low-temperature phase","","- Fe Li O4 Sn -","- Fe Li0.999 O4 Sn0.9995 -","- Fe4 Li3.996 O16 Sn3.998 -","4","0.333333","","Choisnet, J; Hervieu, M; Raveau, B; Tarte, P","Two Polymorphous Lithium Stannoferrites Li Fe Sn O~4~: A Ramsdellite- Type and a Hexagonal Close-Packed Structure","Journal of Solid State Chemistry","1981","40","","344","351","10.1016/0022-4596(81)90401-1","","","","","","0.059","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001227","5.796","0.002","5.796","0.002","9.466","0.005","90","","90","","120","","275.4","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","DILITHIUM DICHROMIUM ALUMINIUM ANTIMONY(V) OXIDE","","- Al Cr2 Li2 O8 Sb -","- Al0.9999 Cr2.0001 Li2 O8 Sb -","- Al1.9998 Cr4.0002 Li4 O16 Sb2 -","2","0.166667","","Tarte, P; Cahay, R; Preudhomme, J; Hervieu, M; Choisnet, J; Raveau, B","Hexagonal-spinel transitions in antimonates Li~2~ Cr(~3-x~) M(III)~x~ Sb O~8~","Journal of Solid State Chemistry","1982","44","","282","289","10.1016/0022-4596(82)90375-9","","","","","","0.039","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001228","5.703","0.002","5.703","0.002","9.392","0.005","90","","90","","120","","264.5","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","DILITHIUM CHROMIUM DIALUMINIUM ANTIMONY(V) OXIDE","","- Al2 Cr Li2 O8 Sb -","- Al2.0001 Cr0.9999 Li2 O8 Sb -","- Al4.0002 Cr1.9998 Li4 O16 Sb2 -","2","0.166667","","Tarte, P; Cahay, R; Preudhomme, J; Hervieu, M; Choisnet, J; Raveau, B","Hexagonal-spinel transitions in antimonates Li~2~ Cr(~3-x~) M(III)~x~ Sb O~8~","Journal of Solid State Chemistry","1982","44","","282","289","10.1016/0022-4596(82)90375-9","","","","","","0.043","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001229","5.867","0.002","5.867","0.002","9.542","0.005","90","","90","","120","","284.4","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","DILITHIUM DICHROMIUM IRON(III) ANTIMONY(V) OXIDE","","- Cr2 Fe Li2 O8 Sb -","- Cr2.0001 Fe0.9999 Li2 O8 Sb -","- Cr4.0002 Fe1.9998 Li4 O16 Sb2 -","2","0.166667","","Tarte, P; Cahay, R; Preudhomme, J; Hervieu, M; Choisnet, J; Raveau, B","Hexagonal-spinel transitions in antimonates Li~2~ Cr(~3-x~) M(III)~x~ Sb O~8~","Journal of Solid State Chemistry","1982","44","","282","289","10.1016/0022-4596(82)90375-9","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001230","5.923","0.002","5.923","0.002","9.641","0.005","90","","90","","120","","292.9","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","DILITHIUM TRIIRON(III) ANTIMONY(V) OXIDE","","- Fe3 Li2 O8 Sb -","- Fe3 Li2 O8 Sb -","- Fe6 Li4 O16 Sb2 -","2","0.166667","","Tarte, P; Cahay, R; Preudhomme, J; Hervieu, M; Choisnet, J; Raveau, B","Hexagonal-spinel transitions in antimonates Li~2~ Cr(~3-x~) M(III)~x~ Sb O~8~","Journal of Solid State Chemistry","1982","44","","282","289","10.1016/0022-4596(82)90375-9","","","","","","0.091","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001288","6.067","0.004","6.067","0.004","9.88","0.008","90","","90","","120","","314.9","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","LITHIUM ZINC TIN OXIDE (1.6/1.6/2.8/8)","","- Li1.6 O8 Sn2.8 Zn1.6 -","- Li1.6 O8 Sn2.8 Zn1.6 -","- Li3.2 O16 Sn5.6 Zn3.2 -","2","0.166667","","Choisnet, J; Raveau, B","Une nouvelle structure hexagonale compacte ordonne: les oxydes (sn - x3)~octa~ (M - Li)~tetra~ O~8~ avec X = Sn(Ti)+ M + Li et M = Zn, Mg","Materials Research Bulletin","1979","14","","1381","1389","10.1016/0025-5408(79)90079-5","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001289","6.077","0.004","6.077","0.004","9.829","0.008","90","","90","","120","","314.4","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","LITHIUM MAGNESIUM TIN OXIDE (1.6/1.6/2.8/8)","","- Li1.6 Mg1.6 O8 Sn2.8 -","- Li1.6 Mg1.6 O8 Sn2.8 -","- Li3.2 Mg3.2 O16 Sn5.6 -","2","0.166667","","Choisnet, J; Raveau, B","Une nouvelle structure hexagonale compacte ordonne: les oxydes (sn - x3)~octa~ (M - Li)~tetra~ O~8~ avec X = Sn(Ti)+ M + Li et M = Zn, Mg","Materials Research Bulletin","1979","14","","1381","1389","10.1016/0025-5408(79)90079-5","","","","","","0.067","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1001290","6.011","0.004","6.011","0.004","9.815","0.008","90","","90","","120","","307.1","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","LITHIUM ZINC TITANIUM TIN OXIDE (1.6/1.6/0.7/2.1/8)","","- Li1.6 O8 Sn2.1 Ti0.7 Zn1.6 -","- Li1.6 O8 Sn2.1001 Ti0.6999 Zn1.6 -","- Li3.2 O16 Sn4.2002 Ti1.3998 Zn3.2 -","2","0.166667","","Choisnet, J; Raveau, B","Une nouvelle structure hexagonale compacte ordonne: les oxydes (sn - x3)~octa~ (M - Li)~tetra~ O~8~ avec X = Sn(Ti)+ M + Li et M = Zn, Mg","Materials Research Bulletin","1979","14","","1381","1389","10.1016/0025-5408(79)90079-5","","","","","","0.071","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1001318","4.466","0.003","4.466","0.003","7.302","0.008","90","","90","","120","","126.1","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","tricadmium arsenide triiodide","","- As0.5 Cd1.5 I1.5 -","- As0.5 Cd1.5 I1.5 -","- As0.5 Cd1.5 I1.5 -","1","0.0833333","","Rebbah, A.; Yazbeck, J.; Deschanvres, A.","Etude structurale des composes Cd~3~YX~3~ (Y=As, P; X=Cl, Br, I)","Revue de Chimie Minerale","1981","19","","43","53","","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","200126","2020-10-21","18:00:00",""
"1001319","4.422","0.009","4.422","0.009","7.24","0.01","90","","90","","120","","122.6","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","tricadmium phosphide triiodide","","- Cd1.5 I1.5 P0.5 -","- Cd1.5 I1.5 P0.5 -","- Cd1.5 I1.5 P0.5 -","1","0.0833333","","Rebbah, A.; Yazbeck, J.; Deschanvres, A.","Etude structurale des composes Cd~3~YX~3~ (Y=As, P; X=Cl, Br, I)","Revue de Chimie Minerale","1981","19","","43","53","","","","","","","0.056","","","","","","","","","","","","","","","has coordinates","200126","2020-10-21","18:00:00",""
"1004115","5.754","0.001","5.754","0.001","13.267","0.003","90","","90","","120","","380.4","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lead vanadium oxide (1/6/11)","","- O11 Pb V6 -","- O11 Pb V6 -","- O22 Pb2 V12 -","2","0.166667","","Mentre, O; Abraham, F","New mixed valence compounds in the Pb - V - O system synthesis and crystal structure of hollandite-related Pb1.32 V8.35 O16.7 and R-type hexagonal ferrite Pb V6 O11","Journal of Solid State Chemistry","1996","125","","91","101","10.1006/jssc.1996.0269","","","","","","0.035","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004123","5.742","0.002","5.742","0.002","13.507","0.005","90","","90","","120","","385.7","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Lead iron vanadium oxide (1/1.75/4.25/11)","","- Fe1.75 O11 Pb V4.25 -","- Fe1.75 O11 Pb V4.25 -","- Fe3.5 O22 Pb2 V8.5 -","2","0.166667","","Mentre, O; Dhaussy, A-C; Abraham, F; Steinfink, H","Effect of iron substitution on the structural, electric, and magnetic properties in R-type Pb Fex V6-x O11, a frustrated system","Journal of Solid State Chemistry","1997","130","","223","233","10.1006/jssc.1997.7294","","","","","","0.049","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1004146","5.566","0.002","5.566","0.002","18.18599","0.005","90","","90","","120","","487.9","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Strontium ruthenium oxide (4/3.05/12)","","- O12 Ru3.05 Sr4 -","- O12 Ru3.05 Sr4 -","- O24 Ru6.1 Sr8 -","2","0.166667","","Renard, C; Daviero-Minaud, S; Huve, M; Abraham, F","Sr4 Ru3.05 O12: a new member of the hexagonal perovskite family","Journal of Solid State Chemistry","1999","144","","125","135","10.1006/jssc.1999.8132","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1005026","9.7311","0.0014","9.7311","0.0014","6.3366","0.0013","90","","90","","120","","519.6","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Lanthanum dicalcium germanium tetrasulfide trichloride","","- Ca2 Cl3 Ge La S4 -","- Ca2.001 Cl3 Ge La0.999 S4 -","- Ca4.002 Cl6 Ge2 La1.998 S8 -","2","0.166667","","Gitzendanner, R L; DiSalvo, F J","Synthesis and structure of a new quinary sulfide halide: La Ca2 Ge S4 Cl3","Inorganic Chemistry","1996","35","","2623","2626","10.1021/ic951184z","","","","","","0.028","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1006077","5.39","0.001","5.39","0.001","8.503","0.001","90","","90","","120","","213.9","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Lanthanum nickel cobalt deuteride (1/4/1/6.1)","","- Co D6.12 La Ni4 -","- Co D6.1197 La Ni4 -","- Co2 D12.2394 La2 Ni8 -","2","0.166667","","Latroche, M; Rodriguez-Carvajal, J; Percheron-Guegan, A; Bouree-Vigneron, F","Structural studies of La Ni4 Co D6.11 and La Ni3.55 Mn0.4 Al0.3 Co0.75 D5.57 by means of neutron powder diffraction","Journal of Alloys Compd.","1995","218","","64","72","10.1016/0925-8388(94)01366-7","","","","","","0.018","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1008043","8.07","","8.07","","13.2","","90","","90","","120","","744.5","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Potassium triytterbium fluoride - $-beta","","- F10 K Yb3 -","","","4","0.333333","","Aleonard, S; le Fur, Y; Pontonnier, L; Gorius, M F; Roux, M T","Quelques Fluorures Mixtes Terre Rare - Metal Alcalin de Structures derivees de celle de la Fluorine","Annales de Chimie (Paris) (Vol=Year)","1978","1978","","417","427","","","","","","","","","","","","","","","","","","","","","","","130149","2020-10-21","18:00:00",""
"1008331","5.412","0.002","5.412","0.002","8.599","0.003","90","","90","","120","","218.1","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lanthanum nickel deuteride (1/5/6.7) - β","","- D6.7 La Ni5 -","- D6.71 La Ni5 -","- D13.42 La2 Ni10 -","2","0.166667","","Lartigue, C.; Percheron-Guegan, A.; Achard, J. C.; Soubeyroux, J. L.","Hydrogen (deuterium) ordering in the β-LaNi~5~D~x>5~ Phases: A Neutron Diffraction Study","Journal of the Less-Common Metals","1985","113","1","127","148","10.1016/0022-5088(85)90155-9","","","","","","0.017","","","","","","","","","","","","","","","has coordinates","200137","2020-10-21","18:00:00",""
"1008332","5.396","0.002","5.396","0.002","8.571","0.002","90","","90","","120","","216.1","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lanthanum nickel deuteride (1/5/6.4) - β","","- D6.4 La Ni5 -","- D6.39 La Ni5 -","- D12.78 La2 Ni10 -","2","0.166667","","Lartigue, C.; Percheron-Guegan, A.; Achard, J. C.; Soubeyroux, J. L.","Hydrogen (deuterium) ordering in the β-LaNi~5~D~x>5~ Phases: A Neutron Diffraction Study","Journal of the Less-Common Metals","1985","113","1","127","148","10.1016/0022-5088(85)90155-9","","","","","","0.024","","","","","","","","","","","","","","","has coordinates","200137","2020-10-21","18:00:00",""
"1008333","5.386","0.002","5.386","0.002","8.544","0.002","90","","90","","120","","214.6","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lanthanum nickel deuteride (1/5/5.9)-β","","- D5.9 La Ni5 -","- D5.91 La Ni5 -","- D11.82 La2 Ni10 -","2","0.166667","","Lartigue, C.; Percheron-Guegan, A.; Achard, J. C.; Soubeyroux, J. L.","Hydrogen (deuterium) ordering in the β-LaNi~5~D~x>5~ Phases: A Neutron Diffraction Study","Journal of the Less-Common Metals","1985","113","1","127","148","10.1016/0022-5088(85)90155-9","","","","","","0.022","","","","","","","","","","","","","","","has coordinates","200137","2020-10-21","18:00:00",""
"1008334","5.395","0.003","5.395","0.003","4.242","0.002","90","","90","","120","","106.9","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lanthanum nickel deuteride (1/5/5.0) - β","","- D5 La Ni5 -","- D5 La Ni5 -","- D10 La2 Ni10 -","2","0.166667","","Lartigue, C.; Percheron-Guegan, A.; Achard, J. C.; Soubeyroux, J. L.","Hydrogen (deuterium) ordering in the β-LaNi~5~D~x>5~ Phases: A Neutron Diffraction Study","Journal of the Less-Common Metals","1985","113","1","127","148","10.1016/0022-5088(85)90155-9","","","","","","0.023","","","","","","","","","","","","","","","has coordinates","200137","2020-10-21","18:00:00",""
"1008347","7.999","0.005","7.999","0.005","17.096","0.002","90","","90","","120","","947.3","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Caesium ytterbium fluoride (1/4/13)","","- Cs F13 Yb4 -","- Cs F13 Yb4 -","- Cs3 F39 Yb12 -","3","0.25","","Aleonard, S; Lambert, B; Pannetier, J; Gorius, M F; Roux, M T","Etude par diffraction neutronique de la phase Cs~4-x~ Yb~12~ F~40-x~ (0 <= X <=1): Hypothese Structurale.","Journal of Solid State Chemistry","1985","58","","226","232","10.1016/0022-4596(85)90239-7","","","","","","0.0593","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008348","7.999","0.005","7.999","0.005","17.078","0.003","90","","90","","120","","946.3","","","","","","","","","","prepared at T = 1373 K","","","3","P 63 m c","P 6c -2c","186","","Caesium ytterbium fluoride (3.4/12/39.4) - prepared at T = 1373 K","","- Cs3.4 F39.4 Yb12 -","- Cs3.4 F39.4 Yb12 -","- Cs3.4 F39.4 Yb12 -","1","0.0833333","","Aleonard, S; Lambert, B; Pannetier, J; Gorius, M F; Roux, M T","Etude par diffraction neutronique de la phase Cs~4-x~ Yb~12~ F~40-x~ (0 <= X <=1): Hypothese Structurale.","Journal of Solid State Chemistry","1985","58","","226","232","10.1016/0022-4596(85)90239-7","","","","","","0.0535","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008349","7.999","0.005","7.999","0.005","17.078","0.003","90","","90","","120","","946.3","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Caesium triytterbium decafluoride","","- Cs F10 Yb3 -","- Cs F10 Yb3 -","- Cs4 F40 Yb12 -","4","0.333333","","Aleonard, S; Lambert, B; Pannetier, J; Gorius, M F; Roux, M T","Etude par diffraction neutronique de la phase Cs~4-x~ Yb~12~ F~40-x~ (0 <= X <=1): Hypothese Structurale.","Journal of Solid State Chemistry","1985","58","","226","232","10.1016/0022-4596(85)90239-7","","","","","","0.0538","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008470","4.35","0.002","4.35","0.002","13.141","0.005","90","","90","","120","","215.3","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Potassium tin antimonide","","- K Sb Sn -","- K Sb Sn -","- K2 Sb2 Sn2 -","2","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","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008518","4.102","0.002","4.102","0.002","12.816","0.005","90","","90","","120","","186.8","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Potassium tin arsenide","","- As K Sn -","- As K Sn -","- As2 K2 Sn2 -","2","0.166667","","Klein, J; Eisenmann, B","Zintl-Phasen mit komplexen Anionen: Darstellung und Einkristallstrukturbestimmung von KSnAs und K~6~Sn~3~As~5~","Materials Research Bulletin","1988","23","","587","594","10.1016/0025-5408(88)90167-5","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008752","5.7732","0.0006","5.7732","0.0006","10.0542","0.0011","90","","90","","120","","290.2","","","","","","","","","","","","synthetic","3","P 63 m c","P 6c -2c","186","","Diiron trimolybdenum(IV) oxide","Kamiokite","- Fe2 Mo3 O8 -","- Fe2 Mo3 O8 -","- Fe4 Mo6 O16 -","2","0.166667","","le Page, Y; Strobel, P","Structure of Iron(II) Molybdenum(IV) Oxide Fe2 Mo3 O8","Acta Crystallographica B (24,1968-38,1982)","1982","38","","1265","1267","10.1107/S0567740882005445","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1009056","5.745","0.001","5.745","","5.622","0.001","90","","90","","120","","160.7","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Molybdenum nitride (1/1) - $-delta","","- Mo N -","- Mo N -","- Mo8 N8 -","8","0.666667","","Bezinge, A; Yvon, K; Muller, J; Lengauer, W; Ettmayer, P","High-pressure high temperature experiments on delta-Mo N","Solid State Communications","1987","63","","141","145","10.1016/0038-1098(87)91183-5","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010168","3.18","0.004","3.18","0.004","5.166","0.005","90","","90","","120","","45.2","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Gallium nitride","","- Ga N -","- Ga N -","- Ga2 N2 -","2","0.166667","","Juza, R; Hahn, H","Ueber die Kristallstrukturen von Cu~3~ N, Ga N und In N","Zeitschrift fuer Anorganische und Allgemeine Chemie","1938","239","","282","287","10.1002/zaac.19382390307","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010169","3.533","0.004","3.533","0.004","5.693","0.004","90","","90","","120","","61.5","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Indium nitride","","- In N -","- In N -","- In2 N2 -","2","0.166667","","Juza, R; Hahn, H","Ueber die Kristallstrukturen von Cu~3~ N, Ga N und In N","Zeitschrift fuer Anorganische und Allgemeine Chemie","1938","239","","282","287","10.1002/zaac.19382390307","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010204","11.73","0.02","11.73","0.02","6.76","0.02","90","","90","","120","","805.5","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Neodymium tris(bromate) nonahydrate","","- Br3 H18 Nd O18 -","- Br3 H18 Nd O18 -","- Br6 H36 Nd2 O36 -","2","0.166667","","Helmholz, L","The Crystal Structure of Neodymium Enneahydrate, Nd (Br O~3~)~3~ (H~2~ O)~9~","Journal of the American Chemical Society","1939","61","","1544","1550","10.1021/ja01875a062","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1010253","7.71","","7.71","","5.42","","90","","90","","120","","279","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Lithium chlorate(VII) trihydrate","","- Cl H6 Li O7 -","- Cl H6 Li O7 -","- Cl2 H12 Li2 O14 -","2","0.166667","","West, C D","Crystal Structures of some Hydrated Compounds.","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1934","88","","198","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1010254","7.45","","7.45","","5.45","","90","","90","","120","","262","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Lithium iodide trihydrate","","- H6 I Li O3 -","- H6 I Li O3 -","- H12 I2 Li2 O6 -","2","0.166667","","West, C D","Crystal Structures of some Hydrated Compounds.","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1934","88","","198","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010263","3.66","","3.66","","10.27","","90","","90","","120","","119.1","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cadmium hydroxochloride","","- Cd Cl H O -","- Cd Cl H2 O -","- Cd2 Cl2 H4 O2 -","2","0.166667","","Hoard, J L; Grenko, J D","The Crystal Structure of Cadmium Hydroxychloride, Cd O H Cl","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1934","87","","110","119","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1010273","3.28","","3.28","","21.55","","90","","90","","120","","200.8","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Aluminium tricarbide nitride","","- C3 Al5 N -","- C3 Al5 N -","- C6 Al10 N2 -","2","0.166667","","Stackelberg, M von; Spiess, K F","Die Struktur des Aluminiumcarbonitrids Al~5~ C~3~ N","Zeitschrift fuer Physikalische Chemie, Abteilung A: Chemische Thermodynamik, Kinetik, Elektrochemie, Eigenschaftslehre","1935","175","","140","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1010274","4.39","0.04","4.39","0.04","7.02","0.06","90","","90","","120","","117.2","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ammonium fluoride","","- F H4 N -","- F H4 N -","- F2 H8 N2 -","2","0.166667","","Zachariasen, W H","Die Kristallstruktur des Ammoniumfluorids.","Zeitschrift fuer Physikalische Chemie (Leipzig)","1927","127","","218","224","","","","","","","","","","","","","","","","","","","","","","has coordinates","200452","2020-10-21","18:00:00",""
"1010514","3.113","","3.113","","4.981","","90","","90","","120","","41.8","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Aluminium nitride","","- Al N -","- Al N -","- Al2 N2 -","2","0.166667","","Ott, H","Das Gitter des Aluminiumnitrids (Al N).","Zeitschrift fuer Physik","1924","22","","201","214","10.1007/BF01328124","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1010526","2.694","","2.694","","4.393","","90","","90","","120","","27.6","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Beryllium oxide","","- Be O -","- Be O -","- Be2 O2 -","2","0.166667","","Zachariasen, W H","Ueber die Kristallstruktur von Be O","Norsk Geologisk Tidsskrift","1925","8","","189","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1010635","3.28","","3.28","","21.55","","90","","90","","120","","200.8","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Pentaaluminium tricarbide nitride","","- C3 Al5 N -","- C3 Al5 N -","- C6 Al10 N2 -","2","0.166667","","Stackelberg, M von; Schnorrenberg, E; Paulus, R; Spiess, K F","Untersuchungen am Aluminiumcarbid Al~4~ C~3~ und Aluminiumcarbonitrid Al~5~ C~3~ N","Zeitschrift fuer Physikalische Chemie, Abteilung A: Chemische Thermodynamik, Kinetik, Elektrochemie, Eigenschaftslehre","1935","175","","127","153","","","","","","","","","","","","","","","","","","","","","","has coordinates","208902","2020-10-21","18:00:00",""
"1010742","3.13","0.01","3.13","","24.7","0.1","90","","90","","120","","209.6","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cobalt bromide hydroxide (4.8/.8/8.8)","","- Br0.75 Co4.75 H8.75 O8.75 -","","","1","0.0833333","","Feitknecht, W; Lotmar, W","Die Struktur des gruenen basischen Kobaltbromids","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1935","91","","136","141","","","","","","","","","","","","","","","","","","","","","","","278158","2022-09-26","15:28:11",""
"1010943","2.685","","2.685","","4.369","","90","","90","","120","","27.3","","","","","","","","","","","","from Langban, Sweden","2","P 63 m c","P 6c -2c","186","","Beryllium oxide","Bromellite","- Be O -","- Be O -","- Be2 O2 -","2","0.166667","","Aminoff, G","Ueber Berylliumoxyd als Mineral und dessen Kristallstruktur.","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1925","62","","113","122","","","","","","","","","","","","","","","","","","","","","","has coordinates","202026","2020-10-21","18:00:00",""
"1011050","4.58","","4.58","","7.51","","90","","90","","120","","136.4","","","","","","","","","","","","synthetic","2","P 63 m c","P 6c -2c","186","","Silver iodine","Iodargyrite","- Ag I -","- Ag I -","- Ag2 I2 -","2","0.166667","","Aminoff, G","Ueber die Kristallstruktur von Ag I.","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1922","57","","180","185","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011054","4.15","","4.15","","6.737","","90","","90","","120","","100.5","","","","","","","","","","","","synthetic","2","P 63 m c","P 6c -2c","186","","Cadmium sulfide - α","Greenockite","- Cd S -","- Cd S -","- Cd2 S2 -","2","0.166667","","Ulrich, F.; Zachariasen, W.","XIV. Über die Kristallstruktur des α- und β-CdS, sowie des Wurtzits","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1925","62","1-6","260","273","10.1524/zkri.1925.62.1.260","","","","","","","","","","","","","","","","","","","","","has coordinates","200075","2020-10-21","18:00:00",""
"1011195","3.8","","3.8","","6.23","","90","","90","","120","","77.9","","","","","","","","","","","","from Pribram, Bohemia","2","P 63 m c","P 6c -2c","186","","Zinc sulfide","Wurtzite 2H","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Aminoff, G.","Untersuchungen ueber die kristallstrukturen von wurtzit und rotnickelkies","Zeitschrift fur Kristallographie","1923","58","","203","219","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011196","3.836","","3.836","","6.277","","90","","90","","120","","80","","","","","","","","","","","","synthetic at 1373 K","2","P 63 m c","P 6c -2c","186","","Zinc sulfide - $-alpha","Wurtzite 2H","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Ulrich, F.; Zachariasen, W. H.","Ueber die kristallstruktur des alpha- und beta-CdS, sowie des wurtzits Locality: synthetic","Zeitschrift fur Kristallographie","1925","62","","260","273","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011229","5.42","","5.42","","8.8","","90","","90","","120","","223.9","","","","","","","","","","","","from Langban, Sweden","4","P 63 m c","P 6c -2c","186","","Sodium tetraberyllium catena-antimonate tetraoxide","Swedenborgite","- Be4 Na O7 Sb -","- Be0.6667 Na O7 Sb -","- Be1.3334 Na2 O14 Sb2 -","2","0.166667","","Aminoff, G","On the structure and chemical composition of Swedenborgite","Kunglia Svenska Vetenskaps Akademiens Handlingar","1933","11","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1011258","3.22","","3.22","","5.2","","90","","90","","120","","46.7","","","","","","","","","","","","synthetic","2","P 63 m c","P 6c -2c","186","","Zinc oxide","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Aminoff, G","Ueber Lauephotogramme und Struktur von Zinkit.","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1921","56","","495","505","","","","","","","","","","","","","","","","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1011259","3.351","","3.351","","5.226","","90","","90","","120","","50.8","","","","","","","","","","","","synthetic","2","P 63 m c","P 6c -2c","186","","Zinc oxide","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Weber, L","Die Struktur von Zn O.","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1923","58","","398","403","","","","","","","","","","","","","","","","","","","","","","has coordinates","201954","2020-10-21","18:00:00",""
"1100044","3.8227","0.0001","3.8227","0.0001","6.2607","0.0001","90","","90","","120","","79.2","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Zinc sulfide","Wurtzite","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Kisi, E. H.; Elcombe, M. M.","u parameters for the wurtzite structure of ZnS and ZnO using powder neutron diffraction","Acta Crystallographica Section C","1989","45","12","1867","1870","10.1107/S0108270189004269","","","","","","0.0575","","","","","","","","","","","","","","","has coordinates","278161","2022-09-26","15:31:04",""
"1100055","10.5319","0.0003","10.5319","0.0003","6.4077","0.0001","90","","90","","120","","615.53","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Calcium Lanthanum Boron Oxide (3/3/5/15)","","- B5 Ca3 La3 O15 -","- B5 Ca3 La3 O15 -","- B10 Ca6 La6 O30 -","2","0.166667","","Zhang, Y; Liang, J; Chen, X; He, M; Xu, T","A structural study of Ca~3~La~3~(BO~3~)~5~","Journal of Alloys and Compounds","2001","327","","96","99","10.1016/S0925-8388(01)01405-0","","","","","","0.08","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1200017","2.47","","2.47","","6.79","","90","","90","","120","","35.9","","","","","","","","","","","","from Kropfm}hl, Bavaria","1","P 63 m c","P 6c -2c","186","","Carbon","Graphite 2H","- C -","- C -","- C4 -","4","0.333333","","Hassel, O","Ueber die Kristallstruktur des Graphits","Zeitschrift fuer Physik","1924","25","","317","337","10.1007/BF01327534","","","","","","","","","","","","","","","","","","","","","has coordinates","202022","2020-10-21","18:00:00",""
"1200019","2.49","","2.49","","4.144","","90","","90","","120","","22.3","","","","","","","","","","","","","1","P 63 m c","P 6c -2c","186","","Carbon","Lonsdaleite","- C -","- C -","- C4 -","4","0.333333","","Yeh, C; Lu, Z W; Froyen, S; Zunger, A","Zinc-blende-Wurtzite polytypism in semiconductors","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1992","46","16","10086","10097","10.1103/PhysRevB.46.10086","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1504403","4.3228","0.001","4.3228","0.001","7.0368","0.001","90","","90","","120","","113.88","0.04","535","2","535","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- B H4 Li -","- B H4 Li -","- B2 H8 Li2 -","2","0.166667","","Filinchuk, Yaroslav; Chernyshov, Dmitry; Cerny, Radovan","Lightest Borohydride Probed by Synchrotron X-ray Diffraction: Experiment Calls for a New Theoretical Revision","Journal of Physical Chemistry C","2008","112","28","10579","","10.1021/jp8025623","","","0.71118","MoKα","","0.0683","0.0642","","","0.1874","0.1919","","","","","","1.046","","","","has coordinates","215051","2020-10-21","18:00:00",""
"1508996","4.2088","","4.2088","","6.8956","","90","","90","","120","","105.784","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Silver cadmium gallium selenide (0.52/0.96/0.52/2)","","- Ag0.52 Cd0.96 Ga0.52 Se2 -","- Ag0.52 Cd0.96 Ga0.52 Se2 -","- Ag0.52 Cd0.96 Ga0.52 Se2 -","1","0.0833333","","Olekseyuk, I.D.; Husak, O.A.; Gulay, L.D.; Kadykalo, E.M.; Parasyuk, O.V.","Phase diagram of the (Ag Ga Se2) - (Cd Se) system and crystal structure of the Ag Cd2 Ga Se4 compound","Journal of Alloys Compd.","2002","343","","125","131","10.1016/S0925-8388(02)00143-3","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1509073","3.334","","3.334","","26.09","","90","","90","","120","","251.152","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Silver niobium sulfide (.22/1/2)","","- Ag0.22 Nb S2 -","- Ag0.215 Nb S2 -","- Ag0.86 Nb4 S8 -","4","0.333333","","van Bolhuis, F.; Wiegers, G.A.; Haange, R.J.","The crystal structure of stage-2 4H- Ag0.22 Nb S2.","Physica Status Solidi, Sectio A: Applied Research","1988","107","","817","824","10.1002/pssa.2211070237","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509125","4.1224","","4.1224","","6.7363","","90","","90","","120","","99.141","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Silver cadmium gallium sulfide selenide (0.5/1/0.5/1/1) - beta","","- Ag0.5 Cd Ga0.5 S Se -","- Ag0.5 Cd Ga0.5 S Se -","- Ag0.5 Cd Ga0.5 S Se -","1","0.0833333","","Husak, O.A.; Parasyuk, O.V.; Gulay, L.D.; Olekseyuk, I.D.","The Ag Ga S2 + 2(Cd Se) <=> Ag Ga Se2 + 2(Cd S) system","Journal of Alloys Compd.","2004","367","","25","35","10.1016/j.jallcom.2003.08.006","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509188","4.5442","","4.5442","","7.7108","","90","","90","","120","","137.894","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ag Ce Ge -","- Ag Ce Ge -","- Ag2 Ce2 Ge2 -","2","0.166667","","Bodak, O.I.; Gschneidner, K.A.jr.; Protsyk, A.S.; Pecharskii, V.K.","The crystal structure, heat capacity (1.5-80 K) and magnetic susceptibility (1.6-300 K) of La Ag Ge and Ce Ag Ge","Journal of the Less-Common Metals","1991","168","","257","267","10.1016/0022-5088(91)90307-P","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1509369","4.5587","","4.5587","","7.8969","","90","","90","","120","","142.125","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ag La Ge","","- Ag Ge La -","- Ag Ge La -","- Ag2 Ge2 La2 -","2","0.166667","","Protsyk, A.S.; Pecharskii, V.K.; Gschneidner, K.A.jr.; Bodak, O.I.","The crystal structure, heat capacity (1.5-80 K) and magnetic susceptibility (1.6-300 K) of La Ag Ge and Ce Ag Ge","Journal of the Less-Common Metals","1991","168","","257","267","10.1016/0022-5088(91)90307-P","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1509401","4.12","","4.12","","6.67","","90","","90","","120","","98.051","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ag In S2 -","- Ag In S2 -","- Ag In S2 -","1","0.0833333","","Klingler, W.; Meyer, A.D.; Hahn, H.; Frank, G.; Stoerger, G.","Ueber einige ternaere Chalkogenide mit Chalkopyritstruktur","Zeitschrift fuer Anorganische und Allgemeine Chemie","1953","271","","153","170","10.1002/zaac.19532710307","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1509581","3.833","","3.833","","30.953","","90","","90","","120","","393.832","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag1.12 Ga2.68 In3.7 S10 -","- Ag1.12 Ga2.68 In3.7 S10 -","- Ag1.12 Ga2.68 In3.7 S10 -","1","0.0833333","","Arzani, R.; Memo, A.; Elitok, E.; Haeuseler, H.","Verbindungen mit Schichtstrukturen in den Systemen (Cu Ga5 S8)/ (Cu In5 S8) und (Ag Ga5 S8)/(Ag In5 S8)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2001","627","","1204","1208","10.1002/1521-3749(200106)627:6<1204::AID-ZAAC1204>3.0.CO;2-V","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510083","4.4603","","4.4603","","7.936","","90","","90","","120","","136.729","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ce Au Ge","","- Au Ce Ge -","- Au Ce Ge -","- Au2 Ce2 Ge2 -","2","0.166667","","Poettgen, R.; Borrmann, H.; Kremer, R.K.","Ferromagnetic ordering in Ce Au Ge","Journal of Magnetism and Magnetic Materials","1996","152","","196","200","10.1016/0304-8853(95)00430-0","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510120","4.411","","4.411","","7.287","","90","","90","","120","","122.787","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Au Dy Ge -","- Au Dy Ge -","- Au2 Dy2 Ge2 -","2","0.166667","","Marazza, R.; Ferro, R.; Rossi, D.","Ternary rare earth alloys, R Au Ge compounds","Journal of Alloys Compd.","1992","187","","267","270","10.1016/0925-8388(92)90432-9","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510163","4.401","","4.401","","7.2326","","90","","90","","120","","121.319","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ho Au Ge","","- Au Ge Ho -","- Au Ge Ho -","- Au2 Ge2 Ho2 -","2","0.166667","","Poettgen, R.; Ouladdiaf, B.; Schnelle, W.; Kremer, R.K.; Gibson, B.J.","Crystal and magnetic structure of antiferromagnetic Ho Au Ge","Journal of Physics: Condensed Matter","2001","13","","2593","2606","10.1088/0953-8984/13/11/315","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510164","4.462","","4.462","","8.1605","","90","","90","","120","","140.704","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","La Au Ge","","- Au Ge La -","- Au Ge La -","- Au2 Ge2 La2 -","2","0.166667","","Kremer, K.; Jepsen, O.; Schnelle, W.; Gmelin, E.; Poettgen, R.","Crystal structure, magnetic susceptibility, electrical resistivity, specific heat and electronic band structure of R Au Ge (R= Sc, Y, La, Lu)","Journal of Physics: Condensed Matter","1997","9","","1435","1450","10.1088/0953-8984/9/7/009","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510166","4.3775","","4.3775","","7.1138","","90","","90","","120","","118.055","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lu Au Ge","","- Au Ge Lu -","- Au Ge Lu -","- Au2 Ge2 Lu2 -","2","0.166667","","Poettgen, R.; Henn, R.W.; Simon, A.; Felser, C.; Borrmann, H.; Kremer, R.K.; Jepsen, O.","Crystal and electronic structures of Sc Au Ge, Ce Au Ge, and Lu Au Ge: a transition from two- to three-dimensional (Au Ge) polyanions","Journal of Alloys Compd.","1996","235","","170","175","10.1016/0925-8388(95)02069-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510169","4.3082","","4.3082","","6.8458","","90","","90","","120","","110.039","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Sc Au Ge","","- Au Ge Sc -","- Au Ge Sc -","- Au2 Ge2 Sc2 -","2","0.166667","","Jepsen, O.; Poettgen, R.; Simon, A.; Kremer, R.K.; Felser, C.; Henn, R.W.; Borrmann, H.","Crystal and electronic structures of Sc Au Ge, Ce Au Ge, and Lu Au Ge: a transition from two- to three-dimensional (Au Ge) polyanions","Journal of Alloys Compd.","1996","235","","170","175","10.1016/0925-8388(95)02069-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510171","4.41","","4.41","","7.3086","","90","","90","","120","","123.095","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Y Au Ge","","- Au Ge Y -","- Au Ge Y -","- Au2 Ge2 Y2 -","2","0.166667","","Kremer, R.K.; Gmelin, E.; Schnelle, W.; Jepsen, O.; Poettgen, R.","Crystal structure, magnetic susceptibility, electrical resistivity, specific heat and electronic band structure of R Au Ge (R= Sc, Y, La, Lu)","Journal of Physics: Condensed Matter","1997","9","","1435","1450","10.1088/0953-8984/9/7/009","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510287","4.452","","4.452","","7.995","","90","","90","","120","","137.233","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Yb Au Sb","","- Au Sb Yb -","- Au Sb Yb -","- Au2 Sb2 Yb2 -","2","0.166667","","Pani, M.; Merlo, F.; Fornasini, M.L.","R M X compounds formed by alkaline earths, europium and ytterbium. I. Ternary phases with M= Cu, Ag, Au; X= Sb, Bi","Journal of the Less-Common Metals","1990","166","","319","327","10.1016/0022-5088(90)90014-B","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510288","4.6374","","4.6374","","7.7289","","90","","90","","120","","143.945","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Yb Au Sb","","- Au Sb Yb -","- Au Sb Yb -","- Au2 Sb2 Yb2 -","2","0.166667","","Hiebl, K.; Rogl, P.; Saccone, A.; Flandorfer, H.; Ferro, R.; Godart, C.","The crystal structure and magnetic properties of Yb M Sb, M = Cu, Ag, Au","Journal of Alloys Compd.","1997","256","","170","174","10.1016/S0925-8388(96)03007-1","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510299","4.288","","4.288","","7.546","","90","","90","","120","","120.159","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Y Au Si","","- Au Si Y -","- Au Si Y -","- Au2 Si2 Y2 -","2","0.166667","","Pani, M.; Fornasini, M.L.; Iandelli, A.","Different stacking of the gold and silicon atoms in the phases RAuSi (R=Sc, Y, Lu)","Journal of Alloys Compd.","1992","187","","243","247","10.1016/0925-8388(92)90538-K","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510305","4.6355","","4.6355","","7.3726","","90","","90","","120","","137.197","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Y Au Sn","","- Au Sn Y -","- Au Sn Y -","- Au2 Sn2 Y2 -","2","0.166667","","Eckert, H.; Sebastian, C.P.; Hoffmann, R.D.; Poettgen, R.; Rayaprol, S.","Crystal chemistry and spectroscopic properties of Sc Au Sn, Y Au Sn, and Lu Au Sn","Solid State Sciences","2006","8","","560","566","10.1016/j.solidstatesciences.2006.01.005","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"1510514","11.07","","11.07","","7.161","","90","","90","","120","","759.975","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Au3 Sr7 -","- Au3 Sr7 -","- Au6 Sr14 -","2","0.166667","","Fornasini, M.L.; Merlo, F.","Crystal structures of the phases Sr3 Ag2, Ca5 Au3, Sr7 Au3 and Sr7 Ag3","Revue de Chimie Minerale","1984","21","","273","281","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510518","10.372","","10.372","","6.514","","90","","90","","120","","606.881","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Au3 Yb7 -","- Au3 Yb7 -","- Au6 Yb14 -","2","0.166667","","Iandelli, A.; Palenzona, A.","The yttrium-gold system","Journal of the Less-Common Metals","1969","18","","221","227","10.1016/0022-5088(69)90160-X","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1510953","7.467","","7.467","","4.71","","90","","90","","120","","227.428","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Ru7 B3","","- B3 Ru7 -","- B3 Ru7 -","- B6 Ru14 -","2","0.166667","","Aronsson, B.","The crystal structure of Ru7 B3","Acta Chemica Scandinavica (1-27,1973-42,1988)","1959","13","","109","114","10.3891/acta.chem.scand.13-0109","","","","","","","","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1518054","7.671","0.005","7.671","0.005","12.49","0.01","90","","90","","120","","636.5","0.8","","","293","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- F7.92 O2.08 Pb0.04 Zr3 -","- F8.15 O1.85 Pb0.0425 Zr3 -","- F32.6 O7.4 Pb0.17 Zr12 -","4","0.333333","","Papiernik, Renee; Frit, Bernard","Structure cristalline de la variete basse temperature de l'oxyfluorure Zr3F8O2","Revue de Chimie Minerale","1984","21","","321","334","","","x-ray","0.71069","MoKα","","","0.031","","","","","","","","","","","","","","has coordinates","176729","2020-10-21","18:00:00",""
"1520991","3.6648","","3.6648","","10.2305","","90","","90","","120","","118.995","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cd (O H) Cl","","- Cd Cl H O -","- Cd Cl H O -","- Cd2 Cl2 H2 O2 -","2","0.166667","","Cudennec, Y.; Riou, A.; Gerault, Y.; Lecerf, A.","Synthesis and crystal structures of Cd (O H) Cl and Cu (O H) Cl and relationship to brucite type","Journal of Solid State Chemistry","2000","151","","308","312","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521004","5.7428","","5.7428","","13.4372","","90","","90","","120","","383.784","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pb Fe V5 O11","","- Fe O11 Pb V5 -","- Fe O11 Pb V5 -","- Fe2 O22 Pb2 V10 -","2","0.166667","","Dhaussy, A.C.; Mentre, O.; Abraham, F.; Calage, Y.","Site preference of Fe and V in Pb Fex V6-x O11 by neutron diffraction and Mossbauer spectroscopy : low temperature investigation for x=1.75","Journal of Solid State Chemistry","1999","147","","609","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521005","5.7413","","5.7413","","13.4626","","90","","90","","120","","384.309","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pb Fe1.22 V4.78 O11","","- Fe1.22 O11 Pb V4.78 -","- Fe1.22 O11 Pb V4.78 -","- Fe2.44 O22 Pb2 V9.56 -","2","0.166667","","Dhaussy, A.C.; Mentre, O.; Abraham, F.; Calage, Y.","Site preference of Fe and V in Pb Fex V6-x O11 by neutron diffraction and Mossbauer spectroscopy : low temperature investigation for x=1.75","Journal of Solid State Chemistry","1999","147","","609","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521006","5.7414","","5.7414","","13.5094","","90","","90","","120","","385.658","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pb Fe1.75 V4.25 O11","","- Fe1.75 O11 Pb V4.25 -","- Fe1.75 O11 Pb V4.25 -","- Fe3.5 O22 Pb2 V8.5 -","2","0.166667","","Dhaussy, A.C.; Mentre, O.; Abraham, F.; Calage, Y.","Site preference of Fe and V in Pb Fex V6-x O11 by neutron diffraction and Mossbauer spectroscopy : low temperature investigation for x=1.75","Journal of Solid State Chemistry","1999","147","","609","617","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1521698","7.3164","","7.3164","","11.7679","","90","","90","","120","","545.537","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Cu8 Ge Se6 -","- Cu8.001 Ge Se6 -","- Cu16.002 Ge2 Se12 -","2","0.166667","","Onoda, M.; Ishii, M.; Pattison, P.; Shibata, K.; Yamamoto, A.; Chapuis, G.","Superspace-group approach to the phase transition of Cu8 Ge Se6","Journal of Solid State Chemistry","1999","146","","355","362","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1522548","9.98","","9.98","","6.276","","90","","90","","120","","541.346","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Gd7 Pd3 -","- Gd7 Pd3 -","- Gd14 Pd6 -","2","0.166667","","Moreau, J.M.; Parthe, E.","Ferromagnetic Gd7 Pd3 and other rare-earth-palladium compounds with non-centrosymmetric Th7 Fe3 structure","Journal of the Less-Common Metals","1973","32","","91","96","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1523622","10.14","","10.14","","6.475","","90","","90","","120","","576.562","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- La7 Ni3 -","- La7 Ni3 -","- La14 Ni6 -","2","0.166667","","Fischer, P.; Haelg, W.; Schlapbach, L.; Yvon, K.","Neutron and X-ray diffraction investigation of deuterium storage in La7 Ni3","Journal of the Less-Common Metals","1978","60","","1","9","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524009","9.83","","9.83","","6.17","","90","","90","","120","","516.325","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Co3 Th7 -","- Co3 Th7 -","- Co6 Th14 -","2","0.166667","","Baenziger, N.C.","The crystal structures of some thorium and uranium compounds","Iowa State College Journal of Science","1952","27","","126","128","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524068","5.767","","5.767","","9.916","","90","","90","","120","","285.606","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Co2 Mo3 O8 -","- Co2 Mo3 O8 -","- Co4 Mo6 O16 -","2","0.166667","","Bertrand, D.; Kerner-Czeskleba, H.","Etude structurale et magnetique de molybdates d'elements de transition","Journal de Physique (Paris)","1975","36","","379","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524069","5.7988","","5.7988","","10.268","","90","","90","","120","","299.015","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mn2 Mo3 O8 -","- Mn2 Mo3 O8 -","- Mn4 Mo6 O16 -","2","0.166667","","Bertrand, D.; Kerner-Czeskleba, H.","Etude structurale et magnetique de molybdates d'elements de transition","Journal de Physique (Paris)","1975","36","","379","390","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1524914","7.256","","7.256","","6.224","","90","","90","","120","","283.788","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Cs Cr Cl3","","- Cl3 Cr Cs -","- Cl3 Cr Cs -","- Cl6 Cr2 Cs2 -","2","0.166667","","McPherson, G.L.; Kistenmacher, T.J.; Folkers, J.B.; Stucky, G.D.","Effect of exchange coupling on the spectra of transition metal ions. The ligand field spectrum and crystal structure of Cs Cr Cl3","Journal of Chemical Physics","1972","57","","3771","3780","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1525131","9.643","","9.643","","6.07","","90","","90","","120","","488.814","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Er7 Rh3 -","- Er7 Rh3 -","- Er14 Rh6 -","2","0.166667","","Raman, A.","Crystal structures of some Ln3 Rh, Ln7 Rh3 and Ln Rh3 phases","Journal of the Less-Common Metals","1972","26","","199","206","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1525666","10.4974","","10.4974","","6.4309","","90","","90","","120","","613.714","","","","","","","","","","","","","7","P 63 m c","P 6c -2c","186","","(Na2.23 Ca0.49 Ce0.09) (Ca0.95 Ce0.69 Sr0.55 Ba0.50 Na0.44) (C O3)5","","- C5 Ba0.5 Ca1.44 Ce0.78 Na2.67 O15 Sr0.55 -","- C5 Ba0.501 Ca1.437 Ce0.78 Na2.667 O15 Sr0.549 -","- C10 Ba1.002 Ca2.874 Ce1.56 Na5.334 O30 Sr1.098 -","2","0.166667","","Belovitskaya, Yu.V.; Pekov, I.V.; Gobechiya, E.R.; Kabalov, Yu.K.; Subbotin, V.V.","Crystal structure of calcioburbankite and the characteristic features of the burbankite structural type","Kristallografiya","2001","46","","1009","1013","","","","","","","","","","","","","","","","","","","","","","has coordinates","146694","2020-10-21","18:00:00",""
"1525736","3.1997","","3.1997","","5.1802","","90","","90","","120","","45.93","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","(Cd0.25 Zn1.13 Ge0.62) (O0.76 N1.24)","","- Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13 -","- Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13 -","- Cd0.25 Ge0.62 N1.24 O0.76 Zn1.13 -","1","0.0833333","","Capitan, M.J.; Louis dit Picard, C.; Laurent, Y.; Odriozola, J.A.","The crystalline structure of germanium oxynitrides within the Cd Zn Ge O N family","Materials Science Forum","2000","325","","25","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","146781","2020-10-21","18:00:00",""
"1525740","2.80247","","2.80247","","9.5358","","90","","90","","120","","64.859","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Li1.03 Co0.94 O1.88","","- Co0.94 Li1.03 O1.88 -","- Co0.94 Li1.03 O1.88 -","- Co1.88 Li2.06 O3.76 -","2","0.166667","","Carlier, D.; Saadoune, I.; Menetrier, M.; Croguennec, L.; Suard, E.; Delmas, C.","On the metastable O2-type Li Co O2","Solid State Ionics","2001","144","","263","276","","","","","","","","","","","","","","","","","","","","","","has coordinates","146785","2020-10-21","18:00:00",""
"1526016","9.2278","","9.2278","","6.8306","","90","","90","","120","","503.716","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(Nd4 N) S3 Cl3","","- Cl3 N Nd4 S3 -","- Cl3 N Nd4 S3 -","- Cl6 N2 Nd8 S6 -","2","0.166667","","Meyer, M.; Schleid, T.; Lissner, F.","Nd3 N Cl6 und Nd4 N S3 Cl3 : Zwei Neodymnitrid-Derivate mit discreten Einheiten Kantenverknuepfter ((N2 Nd6)(12+)) bzw. isolierter (N Nd4)(9+)-Tetraeder","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","1205","1210","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526337","5.993","","5.993","","9.335","","90","","90","","120","","290.358","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Zn2 Sb2 Mg2.45 Fe3.55 O14 (O H)2","","- Fe3.55 H2 Mg2.45 O16 Sb2 Zn2 -","- Fe3.5502 H2 Mg2.4498 O16 Sb2 Zn2 -","- Fe3.5502 H2 Mg2.4498 O16 Sb2 Zn2 -","1","0.0833333","","Holtstam, D.; Gatedal, K.; Soderberg, K.; Norrestam, R.","Rinmanite, Zn2 Sb2 Mg2 Fe4 O14 (O H)2, a new mineral species with a nolanite-type structure from the Garpenberg Norra mine, Dalarna, Sweden","Canadian Mineralogist","2001","39","","1675","1683","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526594","12.773","","12.773","","5.051","","90","","90","","120","","713.664","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","(Fe10.14 Zn1.80) (As O3)6 (O H)6 (As1.536 Si0.492 O6 (O H)0.492)","","- As7.536 Fe10.14 H6.492 O30.492 Si0.492 Zn1.8 -","- As7.536 Fe10.14 H6.492 O30.492 Si0.492 Zn1.8 -","- As7.536 Fe10.14 H6.492 O30.492 Si0.492 Zn1.8 -","1","0.0833333","","Keller, P.","Ekatite, (Fe(3+), Fe(2+), Zn)12 (O H)6 (As O3)6 (As O3, H O Si O3)2, a new mineral from Tsumeb, Namibia, and its crystal structure","European Journal of Mineralogy (1,1989-)","2001","13","","769","777","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526645","7.59","","7.59","","13.886","","90","","90","","120","","692.774","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(Ta2.39 Nb0.61) Te I7","","- I7 Nb0.61 Ta2.39 Te -","- I7 Nb0.606 Ta2.394 Te -","- I14 Nb1.212 Ta4.788 Te2 -","2","0.166667","","Smith, M.D.; Miller, G.J.","Tantalum-niobium mixing in Ta3-x Nbx Te I7 (0 <= x <= 3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","94","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526648","3.657","","3.657","","10.213","","90","","90","","120","","118.286","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cd (O D) Cl","","- Cd Cl D O -","- Cd Cl D0.999 O -","- Cd2 Cl2 D1.998 O2 -","2","0.166667","","Kister, S.; Kockelmann, W.; Keller, H.L.","Hydrogen position, hydrogen bonding and hydroxide dynamics in the Cd (O H) Cl structure type","Physik (Berlin)","2000","276","","262","263","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526651","7.599","","7.599","","13.892","","90","","90","","120","","694.718","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(Ta1.97 Nb1.03) Te I7","","- I7 Nb1.03 Ta1.97 Te -","- I7 Nb1.026 Ta1.974 Te -","- I14 Nb2.052 Ta3.948 Te2 -","2","0.166667","","Smith, M.D.; Miller, G.J.","Tantalum-niobium mixing in Ta3-x Nbx Te I7 (0 <= x <= 3)","Zeitschrift fuer Anorganische und Allgemeine Chemie","2000","626","","94","102","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1526851","12.95","","12.95","","5.117","","90","","90","","120","","743.166","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Na6 Cs2 (Ga6 Ge6 O24) (Ge (O H)6)","","- Cs2 Ga6 Ge7 H6 Na6 O30 -","- Cs2 Ga6 Ge7 Na6 O30 -","- Cs2 Ga6 Ge7 Na6 O30 -","1","0.0833333","","Lee, Y.-J.; Parise, J.B.; Vogt, T.; Kim, S.-J.; Tripathi, A.","Synthesis and crystal structures of gallium and germanium variants of cancrinite","Microporous and Mesoporous Materials","2000","39","","445","455","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527031","3.2436","","3.2436","","5.1983","","90","","90","","120","","47.364","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(Zn0.914 Li0.086) O0.957","","- Li0.086 O0.957 Zn0.914 -","- Li0.086 O0.957 Zn0.914 -","- Li0.172 O1.914 Zn1.828 -","2","0.166667","","Yoshio, K.; Onodera, A.; Satoh, H.; Sakagami, N.; Yamashita, H.","Crystal structure of ZnO:Li at 293K and 19K by X-ray diffraction","Ferroelectrics","2001","264","","133","138","","","","","","","","","","","","","","","","","","","","","","has coordinates","148319","2020-10-21","18:00:00",""
"1527302","3.85","","3.85","","24.68","","90","","90","","120","","316.809","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Zn In2 S4","","- In2 S4 Zn -","- In2 S4 Zn -","- In4 S8 Zn2 -","2","0.166667","","Donika, F.G.; Kiosse, G.A.; Radautsan, S.I.; Semiletov, S.A.; Mustya, I.G.","Crystal structure of the two pack polytypic form Zn In2 S4(II)B","Kristallografiya","1972","17","","663","665","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527393","4.655","","4.655","","7.628","","90","","90","","120","","143.146","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ca Sn Zn -","- Ca Sn Zn -","- Ca2 Sn2 Zn2 -","2","0.166667","","Ganguli, A.K.; Corbett, J.D.","Structure, bonding, and properties of Ca Zn1-x Cdx Sn and Ca Sn.5 Ge1.5","Journal of Solid State Chemistry","1993","107","","480","488","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527423","3.851","","3.851","","30.85","","90","","90","","120","","396.217","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Zn1.685 In2.21 S5","","- In2.16 S5 Zn1.65 -","- In2.16 S5 Zn1.65 -","- In4.32 S10 Zn3.3 -","2","0.166667","","Gnehm, C.; Niggli, A.","Crystal structures in the system Zn-In-S","Journal of Solid State Chemistry","1972","5","","118","125","","","","","","","","","","","","","","","","","","","","","","has coordinates","148996","2020-10-21","18:00:00",""
"1527526","10.843","","10.843","","7.384","","90","","90","","120","","751.833","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ba3 Fe3 Se7 -","- Ba3 Fe3 Se7 -","- Ba6 Fe6 Se14 -","2","0.166667","","Hong, H.Y.-P.; Steinfink, H.","The crystal chemistry of phases in the Ba-Fe-S and Se systems","Journal of Solid State Chemistry","1972","5","","93","104","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527611","6.702","","6.702","","6.405","","90","","90","","120","","249.149","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Nb0.92 S -","- Nb0.92 S -","- Nb7.36 S8 -","8","0.666667","","Kadijk, F.; Jellinek, F.","The system niobium-sulfur","Journal of the Less-Common Metals","1969","19","","421","430","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527665","5.837","","5.837","","14.392","","90","","90","","120","","424.65","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba3 Ni Sb2 O9","","- Ba3 Ni O9 Sb2 -","- Ba3 Ni O9 Sb2 -","- Ba6 Ni2 O18 Sb4 -","2","0.166667","","Koehl, P.; Reinen, D.","Die Kristallstrukturen der hexagonalen Elpasolithe Ba3 Ni Sb2 O9 und Ba3 Cu Sb2 O9 - roentgenographische und spektroskopische Ergebnisse","Zeitschrift fuer Anorganische und Allgemeine Chemie","1977","433","","81","93","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1527693","5.631","","5.631","","4.808","","90","","90","","120","","132.028","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ba Ni O3 -","- Ba Ni O3 -","- Ba2 Ni2 O6 -","2","0.166667","","Krischner, H.; Kolbesen, B.O.; Torkar, K.","Beitraege zum System Ba O-Ni O","Journal of Solid State Chemistry","1971","3","","349","357","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527807","4.649","","4.649","","7.476","","90","","90","","120","","139.933","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Sn Yb Zn -","- Sn Yb Zn -","- Sn2 Yb2 Zn2 -","2","0.166667","","Merlo, F.; Pani, M.; Fornasini, M.L.","R M X compounds formed by alkaline earths, europium and ytterbium- II. Ternary phases with M= Zn, Cd and X= Si, Ge, Sn, Pb","Journal of the Less-Common Metals","1991","171","","329","336","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527888","3.4198","","3.4198","","11.444","","90","","90","","120","","115.907","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Ti2.45 S4","","- S4 Ti2.45 -","- S4 Ti2.4546 -","- S4 Ti2.4546 -","1","0.0833333","","Norrby, L.J.; Franzen, H.F.","Refinement of the Crystal Structure of Nonstoichiometric Ti2+X S4","Journal of Solid State Chemistry","1970","2","","36","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","149677","2020-10-21","18:00:00",""
"1527907","9.802","","9.802","","6.261","","90","","90","","120","","520.959","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ce7 Ru3 -","- Ce7 Ru3 -","- Ce14 Ru6 -","2","0.166667","","Palenzona, A.","The phase diagram of the Ce-Ru system","Journal of Alloys Compd.","1991","176","","241","246","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1527936","8.1","","8.1","","13.34","","90","","90","","120","","757.978","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(N H4) Er3 F10","","- Er3 F10 H4 N -","- Er3 F10 N -","- Er12 F40 N4 -","4","0.333333","","Podberezskaya, N.V.; Borisov, S.V.; Baidina, I.A.; Belov, N.","Kristallicheskaya struktura N H4 Er3 F10 chetyrekhsloinyikationnyi karkas ""Flyuoritovogo"" tipa","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","1976","17","","147","152","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528521","5.7403","","5.7403","","14.0771","","90","","90","","120","","401.71","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba2 Fe0.92 Os1.08 O6","","- Ba2 Fe0.92 O6 Os1.08 -","- Ba2 Fe0.913333 O6 Os1.08667 -","- Ba6 Fe2.74 O18 Os3.26 -","3","0.25","","Gemmill, W.R.; Smith, M.D.; zur Loye, H.C.","Synthesis and structural characterization of two new hexagonal osmates: Ba2 Fe0.92 Os1.08 O6 and Ba2 Co0.77 Os1.23 O6","Solid State Sciences","2007","9","","380","384","","","","","","","","","","","","","","","","","","","","","","has coordinates","150900","2020-10-21","18:00:00",""
"1528522","5.7745","","5.7745","","14.0946","","90","","90","","120","","407.017","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba2 Co0.77 Os1.23 O6","","- Ba2 Co0.77 O6 Os1.23 -","- Ba2 Co0.762 O6 Os1.238 -","- Ba6 Co2.286 O18 Os3.714 -","3","0.25","","Gemmill, W.R.; Smith, M.D.; zur Loye, H.C.","Synthesis and structural characterization of two new hexagonal osmates: Ba2 Fe0.92 Os1.08 O6 and Ba2 Co0.77 Os1.23 O6","Solid State Sciences","2007","9","","380","384","","","","","","","","","","","","","","","","","","","","","","has coordinates","150901","2020-10-21","18:00:00",""
"1528753","5.803","","5.803","","19.07599","","90","","90","","120","","556.318","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Li Ba4 Nb3 O12","","- Ba4 Li Nb3 O12 -","- Ba4 Li Nb3 O12 -","- Ba8 Li2 Nb6 O24 -","2","0.166667","","Negas, T.; Roth, R.S.; Parker, S.; Brower, W.S.","Crystal chemistry of lithium in octahedrally coordinated structures. I. Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II. The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O","Journal of Solid State Chemistry","1973","8","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528754","5.802","","5.802","","19.08499","","90","","90","","120","","556.388","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Li Ba4 Ta3 O12","","- Ba4 Li O12 Ta3 -","- Ba4 Li O12 Ta3 -","- Ba8 Li2 O24 Ta6 -","2","0.166667","","Negas, T.; Roth, R.S.; Brower, W.S.; Parker, S.","Crystal chemistry of lithium in octahedrally coordinated structures. I. Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II. The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O","Journal of Solid State Chemistry","1973","8","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1528755","5.76","","5.76","","23.74199","","90","","90","","120","","682.17","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Li2 Ba5 W3 O15","","- Ba5 Li2 O15 W3 -","- Ba5 Li2 O15 W3 -","- Ba10 Li4 O30 W6 -","2","0.166667","","Negas, T.; Roth, R.S.; Brower, W.S.; Parker, S.","Crystal chemistry of lithium in octahedrally coordinated structures. I. Synthesis of Ba8 (Me6 Li2) O24 (Me = Nb or Ta) and Ba10 (W6 Li4) O30. II. The tetragonal bronze phase in the system Ba O - Nb2 O5 Li2 O","Journal of Solid State Chemistry","1973","8","","1","13","","","","","","","","","","","","","","","","","","","","","","has coordinates","151402","2020-10-21","18:00:00",""
"1528772","4.2613","","4.2613","","69.59","","90","","90","","120","","1094.36","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Cu0.09 Cd0.82 In0.09 Se","","- Cd0.82 Cu0.09 In0.09 Se -","- Cd0.798 Cu0.095 In0.102 Se -","- Cd1.596 Cu0.19 In0.204 Se2 -","2","0.166667","","Olekseyuk, I.D.; Parasyuk, O.V.; Dzham, O.A.; Piskach, L.V.","The reciprocal Cu In Se2 + 2Cd Se = Cu In Se2 + 2 Cd S system. Part I. The quasi-binary Cu In Se2 - Cd Se system: Phase diagram and crystal structure of solid solutions","Journal of Solid State Chemistry","2006","179","","315","322","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529148","7.7457","","7.7457","","6.0075","","90","","90","","120","","312.137","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Hg4 O F6","","- F6 Hg4 O -","- F6 Hg4 O -","- F12 Hg8 O2 -","2","0.166667","","Mueller, B.G.; Klein, W.; Jansen, M.","Hg4 O F6, das erste Quecksilberoxidfluorid","Zeitschrift fuer Anorganische und Allgemeine Chemie","2004","630","","1123","1125","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1529745","4.598","","4.598","","7.514","","90","","90","","120","","137.575","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ag I -","- Ag I -","- Ag2 I2 -","2","0.166667","","Cava, R.J.; Reidinger, F.; Wuensch, B.J.","Single-crystal neutron-diffraction study of Ag I","Solid State Communications","1977","24","","411","416","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1530294","6.35658","","6.35658","","11.5391","","90","","90","","120","","403.784","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Cs2 S2 O6","","- Cs2 O6 S2 -","- Cs2 O6 S2 -","- Cs4 O12 S4 -","2","0.166667","","Liminga, R.; Abrahams, S.C.; Bernstein, J.L.","Piezoelectric Cs2 S2 O6. Room temperature crystal structure","Journal of Chemical Physics","1980","73","","1432","1438","","","","","","","","","","","","","","","","","","","","","","has coordinates","155367","2020-10-21","18:00:00",""
"1530442","7.377","","7.377","","11.88","","90","","90","","120","","559.895","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Rb2 Pu Cl6","","- Cl6 Pu Rb2 -","- Cl6 Pu Rb2 -","- Cl12 Pu2 Rb4 -","2","0.166667","","Morss, L.R.; Fujino, T.","Preparation and crystal structures of plutonium(IV) hexachloro complexes, Rb2 Pu Cl6 and K2 Pu Cl6","Journal of Solid State Chemistry","1988","72","","338","352","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530721","9.146","","9.146","","6.894","","90","","90","","120","","499.418","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Yb4 O Cl6","","- Cl6 O Yb4 -","- Cl6 O Yb4 -","- Cl12 O2 Yb8 -","2","0.166667","","Schleid, T.; Meyer, G.","An oxychloride of divalent ytterbium: Yb4 O Cl6","Journal of the Less-Common Metals","1987","127","","161","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1530883","3.682","","3.682","","6.031","","90","","90","","120","","70.809","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","(Ga2 S3)0.667","","- Ga1.334 S2.001 -","- Ga1.334 S2 -","- Ga1.334 S2 -","1","0.0833333","","Tomas, A.; Guymont, M.; Pardo, M.P.; Guittard, M.; Famery, R.","Determination des structures des formes alpha and beta de Ga2 S3","Materials Research Bulletin","1987","22","","1549","1554","","","","","","","","","","","","","","","","","","","","","","has coordinates","156113","2020-10-21","18:00:00",""
"1531131","10.579","","10.579","","6.5446","","90","","90","","120","","634.312","","","","","","","","","","","","","7","P 63 m c","P 6c -2c","186","","(Na2.75 Ca0.23) (Sr0.63 Ba1.08 Ce0.82 Ca0.46) (C O3)5","","- C5 Ba1.08 Ca0.69 Ce0.82 Na2.75 O15 Sr0.63 -","- C5 Ba1.08 Ca0.6891 Ce0.819 Na2.7501 O15 Sr0.63 -","- C10 Ba2.16 Ca1.3782 Ce1.638 Na5.5002 O30 Sr1.26 -","2","0.166667","","Belovitskaya, Yu.V.; Pekov, I.V.; Schneider, J.; Kabalov, Yu.K.; Gobechiya, E.R.","Determination of the crystal structure of khanneshite by the Rietveld method","Kristallografiya","2002","47","","46","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","156475","2020-10-21","18:00:00",""
"1531188","8.996","","8.996","","6.951","","90","","90","","120","","487.166","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Na6 (Mn S4)","","- Mn Na6 S4 -","- Mn Na6 S4 -","- Mn2 Na12 S8 -","2","0.166667","","Bronger, W.; Boehmer, M.; Mueller, P.","Magnetic properties of the ternary sulfide Na6 Mn S4","Journal of Alloys Compd.","2002","338","","116","120","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531359","5.363","","5.363","","8.723","","90","","90","","120","","217.276","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","La Ni5 H7","","- H7 La Ni5 -","- H7 La Ni5 -","- H14 La2 Ni10 -","2","0.166667","","Hector, L.G.jr.; Herbst, J.F.; Capehart, T.W.","Electronic structure calculations for La Ni5 and La Ni5 H7: energetics and elastic properties","Journal of Alloys Compd.","2003","353","","74","85","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531382","5.7","","5.7","","27.6","","90","","90","","120","","776.586","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Al24 (Fe0.5 Mg0.5)8 (Fe0.5 Ti0.5)2 O46 (O H)2","","- Al24 Fe5 H2 Mg4 O48 Ti -","- Al24 Fe5 H2 Mg4 O48 Ti -","- Al24 Fe5 H2 Mg4 O48 Ti -","1","0.0833333","","Hejny, C.; Armbruster, T.","Polysomatism in hoegbomite: the crystal structures of 10T, 12H, 14Tand 24R polysomes","American Mineralogist","2002","87","","277","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1531387","5.712","","5.712","","18.317","","90","","90","","120","","517.561","","","","","","","","","","","","","7","P 63 m c","P 6c -2c","186","","(Fe1.2 Ti0.8) Al14 ((Fe0.765 Zn0.235)4 (Al0.461 Mg0.539)2) O30 (O H)2","","- Al14.922 Fe4.26 H2 Mg1.078 O32 Ti0.8 Zn0.94 -","- Al14.924 Fe4.26 Mg1.076 O32 Ti0.8 Zn0.94 -","- Al14.924 Fe4.26 Mg1.076 O32 Ti0.8 Zn0.94 -","1","0.0833333","","Hejny, C.; Gnos, E.; Armbruster, T.; Grobety, B.","Crystal chemistry of the polysome ferrohoegbomite-2N2S, a long-known but newly defined mineral species","European Journal of Mineralogy (1,1989-)","2002","14","","957","967","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532360","6.2907","","6.2907","","10.2691","","90","","90","","120","","351.934","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Y Ba Co4 O7","","- Ba Co4 O7 Y -","- Ba Co4 O7 Y -","- Ba2 Co8 O14 Y2 -","2","0.166667","","Valldor, M.; Andersson, M.","The structure of the new compound Y Ba Co4 O7 with a magnetic feature","Solid State Sciences","2002","4","","923","931","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532694","5.3954","","5.3954","","8.5858","","90","","90","","120","","216.451","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","La Ni5 D6.57","","- D6.57 La Ni5 -","- D6.566 La Ni5 -","- D13.132 La2 Ni10 -","2","0.166667","","Latroche, M.; Joubert, J.M.; Percheron-Guegan, A.; Bouree-Vigneron, F.","Neutron diffraction study of the deuterides of the over-stoichiometric compounds La Ni5+x","Journal of Solid State Chemistry","2004","177","","1219","1229","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1532697","5.361","","5.361","","8.5732","","90","","90","","120","","213.386","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","La0.97 Ni5.06 D6.18","","- D6.18 La0.97 Ni5.06 -","- D6.182 La0.972 Ni5.0552 -","- D12.364 La1.944 Ni10.1104 -","2","0.166667","","Latroche, M.; Joubert, J.M.; Percheron-Guegan, A.; Bouree-Vigneron, F.","Neutron diffraction study of the deuterides of the over-stoichiometric compounds La Ni5+x","Journal of Solid State Chemistry","2004","177","","1219","1229","","","","","","","","","","","","","","","","","","","","","","has coordinates","158653","2020-10-21","18:00:00",""
"1532798","5.73659","","5.73659","","5.61884","","90","","90","","120","","160.135","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mo N -","- Mo N -","- Mo8 N8 -","8","0.666667","","Bull, C.L.; McMillan, P.F.; Soignard, E.; Leinenweber, K.","Determination of the crystal structure of delta-(Mo N) by neutron diffraction","Journal of Solid State Chemistry","2004","177","","1488","1492","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1533020","3.2538","","3.2538","","5.2044","","90","","90","","120","","47.718","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(Zn0.85 Co0.15) O","","- Co0.15 O Zn0.85 -","- Co0.15 O Zn0.85 -","- Co0.3 O2 Zn1.7 -","2","0.166667","","Qi Zeming; Li Aixia; Su Fenglian; Zhao Zongyan; Zhou Shengming; Liu Yanmei","X-ray diffraction analysis of Zn0.85 Co0.15 O powder and thin films","Materials Research Bulletin","2003","38","","1791","1796","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534280","4.175","","4.175","","6.783","","90","","90","","120","","102.392","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Li Ga Ge","","- Ga Ge Li -","- Ga Ge Li -","- Ga2 Ge2 Li2 -","2","0.166667","","Bockelmann, W.; Jacobs, H.; Schuster, H.U.","Ternaere Phasen im Dreistoffsystem Lithium-Gallium-Germanium","Zeitschrift fuer Anorganische und Allgemeine Chemie","1974","410","","233","2406","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534283","5.855","","5.855","","9.503","","90","","90","","120","","282.127","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Rb2 (Mn F6)","","- F6 Mn Rb2 -","- F6 Mn Rb2 -","- F12 Mn2 Rb4 -","2","0.166667","","Bode, H.; Wendt, W.","Ueber die Struktur von Hexafluoromanganaten(IV)","Zeitschrift fuer Anorganische und Allgemeine Chemie","1952","269","","165","172","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534285","5.94","","5.94","","9.63","","90","","90","","120","","294.259","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Rb2 (Ge F6)","","- F6 Ge Rb2 -","- F6 Ge Rb2 -","- F12 Ge2 Rb4 -","2","0.166667","","Bode, H.; Brockmann, R.","Zur Kristallstruktur der Hexafluorogermanate","Zeitschrift fuer Anorganische und Allgemeine Chemie","1952","269","","173","178","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534565","3.8134","","3.8134","","30.656","","90","","90","","120","","386.074","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(Ga In S3)3.333","","- Ga3.333 In3.333 S9.999 -","- Ga3.3332 In3.3332 S10 -","- Ga3.3332 In3.3332 S10 -","1","0.0833333","","Amiraslanov, I.R.; Asadov, Yu.G.; Valiev, R.B.; Musaev, A.A.; Guseinov, G.G.","Structure and intercalation of Ga InS 3 (b,II) polytype","Kristallografiya","1990","35","","1298","1299","","","","","","","","","","","","","","","","","","","","","","has coordinates","161394","2020-10-21","18:00:00",""
"1534624","11.299","","11.299","","7.334","","90","","90","","120","","810.871","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Ba7 (Si O4) (B O3)3 (C N)","","- C B3 Ba7 N O13 Si -","- C B3 Ba7 N O13 Si -","- C2 B6 Ba14 N2 O26 Si2 -","2","0.166667","","Schmid, S.; Senker, J.; Schnick, W.","High-temperature synthesis, single-crystal X-ray structure determination and solid-state NMR investigations of Ba7 (Si O4) (B O3)3 C N and Sr7 (Si O4) (B O3)3 C N","Journal of Solid State Chemistry","2003","174","","221","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1534627","10.813","","10.813","","6.952","","90","","90","","120","","703.935","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Sr7 (Si O4) (B O3)3 (C N)","","- C B3 N O13 Si Sr7 -","- C B3 N O13 Si Sr7 -","- C2 B6 N2 O26 Si2 Sr14 -","2","0.166667","","Schmid, S.; Senker, J.; Schnick, W.","High-temperature synthesis, single-crystal X-ray structure determination and solid-state NMR investigations of Ba7 (Si O4) (B O3)3 C N and Sr7 (Si O4) (B O3)3 C N","Journal of Solid State Chemistry","2003","174","","221","228","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535039","7.5034","","7.5034","","6.5152","","90","","90","","120","","317.669","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Fe (N O)3 I","","- Fe1.02 I1.02 N3 O3 -","- Fe1.02 I1.02 N3 O3 -","- Fe2.04 I2.04 N6 O6 -","2","0.166667","","Beck, W.; Enzmann, A.; Mayer, P.","Formation and structure of iodotrinitrosyliron, [Fe (N O)3 I]","Zeitschrift fuer Anorganische und Allgemeine Chemie","2005","631","","105","109","","","","","","","","","","","","","","","","","","","","","","has coordinates","162166","2020-10-21","18:00:00",""
"1535150","5.8014","","5.8014","","19.205","","90","","90","","120","","559.771","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba4 Na Ru3 O12","","- Ba4 Na O12 Ru3 -","- Ba4 Na O12 Ru3 -","- Ba8 Na2 O24 Ru6 -","2","0.166667","","Stitzer, K.E.; Gemmill, W.R.; Smith, M.D.; zur Loye, H.C.","Crystal growth of a novel oxygen-deficient layered perovskite: Ba7 Li3 Ru4 O20","Journal of Solid State Chemistry","2003","175","","39","45","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535248","4.2136","","4.2136","","7.039","","90","","90","","120","","108.23","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Yb Cu Ge","","- Cu Ge Yb -","- Cu Ge Yb -","- Cu2 Ge2 Yb2 -","2","0.166667","","Heying, B.; Rodewald, U.C.; Ochiai, A.; Poettgen, R.; Katoh, K.; Niide, Y.","Synthesis and Structure of YbCuGe and YbIrGe","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","2005","136","","655","661","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535307","9.8946","","9.8946","","16.269","","90","","90","","120","","1379.39","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Rb Li7 Ge8","","- Ge8 Li7 Rb -","- Ge8 Li7 Rb -","- Ge32 Li28 Rb4 -","4","0.333333","","Bobev, S.; Sevov, S.C.","Synthesis and characterization of Rb Li7 Ge8 with isolated closo-(Li4 Ge12)(8-) ions, lithium-capped truncated tetrahedra of (Ge12)(12-)","Angew. Chem. Int. ed.","2001","40","","1507","1510","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535440","3.144","","3.144","","5.046","","90","","90","","120","","43.196","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Al N -","- Al N -","- Al2 N2 -","2","0.166667","","Miwa, K.; Fukumoto, A.","First-principles calculation of the structural, electronic, and vibrational properties of gallium nitride and aluminum aluminum nitride","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1993","48","","7897","7902","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535443","3.146","","3.146","","5.125","","90","","90","","120","","43.928","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ga N -","- Ga N -","- Ga2 N2 -","2","0.166667","","Miwa, K.; Fukumoto, A.","First-principles calculation of the structural, electronic, and vibrational properties of gallium nitride and aluminum aluminum nitride","Physical Review, Serie 3. B - Condensed Matter (18,1978-)","1993","48","","7897","7902","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535748","9.5553","","9.5553","","6.9516","","90","","90","","120","","549.673","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Mn Nd4 O Se6 -","- Mn Nd4 O Se6 -","- Mn2 Nd8 O2 Se12 -","2","0.166667","","Ijjaali, I.; Bin Deng; Ibers, J.A.","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535752","9.6795","","9.6795","","7.0235","","90","","90","","120","","569.889","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Mn Ce4 O Se6","","- Ce4 Mn O Se6 -","- Ce4 Mn O Se6 -","- Ce8 Mn2 O2 Se12 -","2","0.166667","","Ijjaali, I.; Bin Deng; Ibers, J.A.","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535755","9.6405","","9.6405","","6.9888","","90","","90","","120","","562.513","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Fe Ce4 O Se6","","- Ce4 Fe O Se6 -","- Ce4 Fe O Se6 -","- Ce8 Fe2 O2 Se12 -","2","0.166667","","Ijjaali, I.; Bin Deng; Ibers, J.A.","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535759","9.7596","","9.7596","","7.0722","","90","","90","","120","","583.377","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Mn La4 O Se6","","- La4 Mn O Se6 -","- La4 Mn O Se6 -","- La8 Mn2 O2 Se12 -","2","0.166667","","Ijjaali, I.; Ibers, J.A.; Bin Deng","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535764","9.4489","","9.4489","","6.8784","","90","","90","","120","","531.839","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Fe Sm4 O Se6","","- Fe O Se6 Sm4 -","- Fe O Se6 Sm4 -","- Fe2 O2 Se12 Sm8 -","2","0.166667","","Ijjaali, I.; Bin Deng; Ibers, J.A.","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535768","9.4766","","9.4766","","6.8246","","90","","90","","120","","530.778","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Mn La4 O S6","","- La4 Mn O S6 -","- La4 Mn O S6 -","- La8 Mn2 O2 S12 -","2","0.166667","","Ijjaali, I.; Ibers, J.A.; Bin Deng","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535773","9.7388","","9.7388","","7.0512","","90","","90","","120","","579.168","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Fe La4 O Se6 -","- Fe La4 O Se6 -","- Fe2 La8 O2 Se12 -","2","0.166667","","Ijjaali, I.; Bin Deng; Ibers, J.A.","Seven new rare-earth transition-metal oxychalcogenides: Syntheses and characterization of Ln4 Mn O Se6 (Ln = La, Ce, Nd), Ln4 Fe O Se6 (Ln = La, Ce, Sm), and La4 Mn O S6","Journal of Solid State Chemistry","2005","178","","1503","1507","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1535808","5.507","","5.507","","7.171","","90","","90","","120","","188.339","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Ca2 Ge O4","","- Ca2 Ge -","- Ca2 Ge -","- Ca4 Ge2 -","2","0.166667","","Udagawa, S.; Urabe, K.; Katayama, K.","Crystal structure analysis of alpha-Ca2 Ge O4","Semento Hijutsu Nempo","1976","30","","37","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535832","9.064","","9.064","","14.339","","90","","90","","120","","1020.21","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","K6 (Bi Cl6) Cl2 (H3 F4)","","- Bi Cl8 F4 H3 K6 -","- Bi Cl8 F4 H3 K6 -","- Bi2 Cl16 F8 H6 K12 -","2","0.166667","","Udovenko, A.A.; Davidovich, R.L.","Crystal structure of triple salt K3BiCl6*2KCl*KH3F4 at 103K","Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))","1991","17","","1545","1546","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535835","5.284","","5.284","","12.78","","90","","90","","120","","309.02","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba Ca (C O3)2","","- C Ba Ca O3 -","- C Ba Ca O3 -","- C2 Ba2 Ca2 O6 -","2","0.166667","","Donnay, G.; Preston, H.","Ewaldite, a New Barium Calcium Carbonate","Tschermaks Mineralogische und Petrographische Mitteilungen (-1978)","1971","15","","201","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535932","6.329","","6.329","","10.15","","90","","90","","120","","352.101","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Ca Ba Zn2.155 Fe0.735 Al1.11 O7","","- Al1.11 Ba Ca Fe0.735 O7 Zn2.155 -","- Al1.111 Ba Ca Fe0.735 O7 Zn2.15457 -","- Al2.222 Ba2 Ca2 Fe1.47 O14 Zn4.30914 -","2","0.166667","","Valldor, M.","Syntheses and structures of compounds with the YBaCo4O7-type structure","Solid State Sciences","2004","6","","251","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1535936","6.3331","","6.3331","","10.1964","","90","","90","","120","","354.169","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Ca Ba Co2.208 Zn1.632 Al0.16 O7","","- Al0.16 Ba Ca Co2.208 O7 Zn1.632 -","- Al0.16 Ba Ca Co2.208 O7 Zn1.632 -","- Al0.32 Ba2 Ca2 Co4.416 O14 Zn3.264 -","2","0.166667","","Valldor, M.","Syntheses and structures of compounds with the Y Ba Co4 O7-type structure","Solid State Sciences","2004","6","","251","266","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536125","5.318","","5.318","","12.837","","90","","90","","120","","314.406","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba Ca (C O3)2 (H2 O)2.6","","- C Ba Ca O6.93 -","- C Ba Ca O8.64 -","- C2 Ba2 Ca2 O17.28 -","2","0.166667","","Voloshin, A.V.; Subbotin, V.V.; Yakovenchuk, V.N.; Pakhomovskii, Ya.A.; Nadezhina, T.N.; Men'shikov, Yu.P.; Pushcharovskii, D.Yu.","New data on the ewaldite","Zapiski Vserossijskogo Mineralogicheskogo Obshchestva","1992","1992","","56","67","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536397","3.713","","3.713","","6.07","","90","","90","","120","","72.472","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(Ga1.96 Li0.12 S3).667","","- Ga1.30732 Li0.08004 S2.001 -","- Ga1.3074 Li0.08 S2 -","- Ga1.3074 Li0.08 S2 -","1","0.0833333","","Palazzi, M.; Carcaly, C.","Stabilisation de la forme wurtzite de Ga2 S3 par le sulfure de lithium","Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, Serie 2 (-1983)","1983","296","","439","442","","","","","","","","","","","","","","","","","","","","","","has coordinates","164083","2020-10-21","18:00:00",""
"1536862","12.761","","12.761","","21.416","","90","","90","","120","","3020.22","","","","","","","","","","","","","7","P 63 m c","P 6c -2c","186","","Na5.505 Ca2.45 K0.2 (Al6 Si6 O24) (S O4)1.325 (C O3)0.5 Cl1.4 (H2 O)","","- C0.5 Al6 Ca2.45 Na5.505 O29.505 S1.325 Si6 -","- C0.5 Al6 Ca2.45 Na5.505 O29.505 S1.325 Si6 -","- C2 Al24 Ca9.8 Na22.02 O118.02 S5.3 Si24 -","4","0.333333","","Rastsvetaeva, R.K.; Sapozhnikov, A.N.; Pobedimskaya, E.A.; Terent'eva, L.E.","Structural features of afganite and its place among cancrinite group minerals","Kristallografiya","1993","38","","94","103","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536864","6.203","","6.203","","7.598","","90","","90","","120","","253.182","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Na2 Mn O4","","- Mn Na2 O4 -","- Mn Na2 O4 -","- Mn2 Na4 O8 -","2","0.166667","","Kopelev, N.S.; Val'kovskii, M.D.; Popov, A.I.; Chumaevskii, N.A.","Synthesis and properties of sodium manganates.","Zhurnal Neorganicheskoi Khimii","1991","36","","2210","2215","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1536946","8.989","","8.989","","7.522","","90","","90","","120","","526.365","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ca3 Ni8 In4","","- Ca3 In4 Ni8 -","- Ca3 In4 Ni8 -","- Ca6 In8 Ni16 -","2","0.166667","","Zaremba, V.; Muts, I.; Poettgen, R.; Kal'ichak, Ya.M.; Hoffmann, R.D.","Ca3 Ni8 In4 - An ordered non-centrosymmetric variant of the Ba Li4 type","Journal of Solid State Chemistry","2001","160","","415","420","","","","","","","","","","","","","","","","","","","","","","has coordinates","164857","2020-10-21","18:00:00",""
"1537090","10.3596","","10.3596","","6.8647","","90","","90","","120","","638.026","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Dy3 (Se O3)4 F","","- Dy3 F O12 Se4 -","- Dy3 F O12 Se4 -","- Dy6 F2 O24 Se8 -","2","0.166667","","Kruegermann, I.; Wickleder, M.S.","Synthesis and crystal structures of Er2 (Se O3)3 and Dy3 (Se O3)4 F","Journal of Solid State Chemistry","2002","167","","113","118","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537298","6.939","","6.939","","11.986","","90","","90","","120","","499.803","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Cs Mg (P O4) (H2 O)6","","- Cs H12 Mg O10 P -","- Cs Mg O10 P -","- Cs2 Mg2 O20 P2 -","2","0.166667","","Ferrari, A.; Cavalca, L.; Nardelli, M.","Sulla struttura del fosfato e dell'arseniato di cesio e magnesio esaidrati. Nota II","Gazzetta Chimica Italiana","1955","85","","1232","1238","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537342","10.821","","10.821","","6.753","","90","","90","","120","","684.798","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Na7 (S O4)3 (Sn F3)","","- F3 Na7 O12 S3 Sn -","- F3 Na7 O12 S3 Sn -","- F6 Na14 O24 S6 Sn2 -","2","0.166667","","Gorbunova, Yu.E.; Detkov, D.G.; Kokunov, Yu.V.","Synthesis and structure of Na7 (S O4)3 Sn F3: complex anion (Sn F3)- in a cationic sodium-sulfate framework","Zhurnal Neorganicheskoi Khimii","2004","49","","1459","1462","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537347","3.2","","3.2","","5.1","","90","","90","","120","","45.227","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Al2 O C","","- C Al2 O -","- C Al2 O -","- C Al2 O -","1","0.0833333","","Grass, V.E.; Sitnikov, P.A.; Ryabkov, Yu.I.; Goldin, B.A.","X-ray diffraction study of the aluminium monoxycarbide","Zhurnal Strukturnoi Khimii (Issue-No. from 1981)","2004","45","","103","109","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537411","3.1","","3.1","","8.32","","90","","90","","120","","69.243","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Pt O2","","- O2 Pt -","- O2 Pt -","- O4 Pt2 -","2","0.166667","","Hoekstra, H.R.; Siegel, S.; Gallagher, F.X.","Reaction of platinum dioxide with some metal oxides","Advances in Chemistry Series","1971","98","","39","53","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537442","3.436","","3.436","","25.532","","90","","90","","120","","261.049","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Ta Se2","","- Se2 Ta -","- Se2 Ta -","- Se8 Ta4 -","4","0.333333","","Huisman, R.; Jellinek, F.","On the polymorphism of tantalum diselenide","Journal of the Less-Common Metals","1969","17","","111","117","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1537593","3.71","","3.71","","6.03","","90","","90","","120","","71.878","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cr Se -","- Cr Se -","- Cr2 Se2 -","2","0.166667","","Lotgering, F.K.; Gorter, E.W.","Solid solutions between ferromagnetic and antiferromagnetic compounds with Ni As structure","Journal of Physics and Chemistry of Solids","1957","3","","238","249","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538467","3.7547","","3.7547","","11.4014","","90","","90","","120","","139.2","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Zn0.99 Ca1.05 O1.11 S0.99","","- Ca1.05 O1.11 S0.99 Zn0.99 -","- Ca1.05 O1.109 S0.994 Zn0.989 -","- Ca2.1 O2.218 S1.988 Zn1.978 -","2","0.166667","","Petrova, S.A.; Zakharov, R.G.; Mar'evich, V.P.; Selivanov, E.N.; Udoeva, L.Yu.; Chumarev, V.M.","Crystal structure of zinc calcium oxysulfide","Doklady Akad. Nauk","2003","393","","52","56","","","","","","","","","","","","","","","","","","","","","","has coordinates","167037","2020-10-21","18:00:00",""
"1538475","8.425","","8.425","","8.765","","90","","90","","120","","538.794","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","I (N I4) (N H3)","","- H3 I5 N2 -","- I5 N2 -","- I10 N4 -","2","0.166667","","Plewa, M.; Tebbe, K.F.","I (N I4) (N H3), ein neues Derivat des Iodstickstoffs","Zeitschrift fuer Anorganische und Allgemeine Chemie","1981","477","","7","20","","","","","","","","","","","","","","","","","","","","","","has coordinates","167050","2020-10-21","18:00:00",""
"1538547","3.744","","3.744","","12.51","","90","","90","","120","","151.866","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Zr2.46 Se4","","- Se4 Zr2.46 -","- Se4 Zr2.46 -","- Se4 Zr2.46 -","1","0.0833333","","Salomons, W.; Wiegers, G.A.","The system zirconium-selenium. Structures of the phases Zr3 Se4 and Zr2 Se3","Recueil des Travaux Chimiques des Pays-Bas et de la Belgique","1968","87","","1339","1344","","","","","","","","","","","","","","","","","","","","","","has coordinates","167180","2020-10-21","18:00:00",""
"1538558","3.89","","3.89","","6.3","","90","","90","","120","","82.56","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Al1.33 Se2 -","- Al1.3334 Se2 -","- Al1.3334 Se2 -","1","0.0833333","","Schneider, A.; Gattow, G.","Beitrag zum System Aluminium-Selen","Zeitschrift fuer Anorganische und Allgemeine Chemie","1954","277","","49","59","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538744","4.54","","4.54","","7.395","","90","","90","","120","","132.002","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mg Te -","- Mg Te -","- Mg2 Te2 -","2","0.166667","","Klemm, W.; Wahl, K.","Notiz ueber das Magnesiumtellurid","Zeitschrift fuer Anorganische und Allgemeine Chemie","1951","266","","289","289","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1538836","3.996","","3.996","","6.446","","90","","90","","120","","89.14","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mn S -","- Mn S -","- Mn2 S2 -","2","0.166667","","Mehmed, F.; Haraldsen, H.","Magnetochemische Untersuchungern. XXVIII. Das magnetische Verhalten der allotropen Modifikationen des Mangan(II)-Sulfides","Zeitschrift fuer Anorganische und Allgemeine Chemie","1938","235","","193","200","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539043","4.601303","","4.601303","","7.29004","","90","","90","","120","","133.666","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Pd Sn U -","- Pd Sn U -","- Pd2 Sn2 U2 -","2","0.166667","","Robinson, R.A.; de Boer, F.R.; Lawson, A.C.; Buschow, K.H.J.; von Dreele, R.B.; Sechovsky, V.","Low temperature magnetic structures of U Pd Sn","Journal of Magnetism and Magnetic Materials","1991","98","","147","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"1539202","9.465","","9.465","","7.18","","90","","90","","120","","557.053","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Sm4 O Cl6","","- Cl6 O Sm4 -","- Cl6 O Sm4 -","- Cl12 O2 Sm8 -","2","0.166667","","Schleid, T.; Meyer, G.","Divalent samarium: Synthesis and crystal structures of Sm4 O Cl6 and K Sm2 Cl5","Zeitschrift fuer Anorganische und Allgemeine Chemie","1987","553","","231","238","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539208","9.446","","9.446","","7.161","","90","","90","","120","","553.35","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Eu4 O Cl6","","- Cl6 Eu4 O -","- Cl6 Eu4 O -","- Cl12 Eu8 O2 -","2","0.166667","","Schleid, T.; Meyer, G.","Eu4 O Cl6 and Eu4 O Br6: Crystal Growth and Structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1987","554","","118","122","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539210","9.826","","9.826","","7.5","","90","","90","","120","","627.112","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Eu4 O Br6","","- Br6 Eu4 O -","- Br6 Eu4 O -","- Br12 Eu8 O2 -","2","0.166667","","Schleid, T.; Meyer, G.","Eu4 O Cl6 and Eu4 O Br6: Crystal Growth and Structure","Zeitschrift fuer Anorganische und Allgemeine Chemie","1987","554","","118","122","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539614","3.209","","3.209","","5.1927","","90","","90","","120","","46.309","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Zn1.231 Ge.689 O.782 N1.218","","- Ge0.689 N1.218 O0.782 Zn1.231 -","- Ge0.69 N1.218 O0.782 Zn1.232 -","- Ge0.69 N1.218 O0.782 Zn1.232 -","1","0.0833333","","Bacher, P.; Roult, G.; Merdrignac, O.; Ghers, M.; Guyader, J.; Laurent, Y.","Structure and crystallization of zinc and germanium oxynitrides determined by neutron diffraction","Materials Chemistry and Physics","1989","21","","223","235","","","","","","","","","","","","","","","","","","","","","","has coordinates","168575","2020-10-21","18:00:00",""
"1539813","6.882","","6.882","","5.723","","90","","90","","120","","234.738","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Fe.8 Co.2 S","","- Co0.2 Fe0.8 S -","- Co0.2 Fe0.8 S -","- Co1.6 Fe6.4 S8 -","8","0.666667","","Collin, G.; Gardette, M.F.; Comes, R.","The Fe1-x Cox S system (X<0.25); transition and the high temperature phase","Journal of Physics and Chemistry of Solids","1987","48","","791","802","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539821","6.926","","6.926","","5.78","","90","","90","","120","","240.117","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(Fe0.92 Co0.08) S","","- Co0.08 Fe0.92 S -","- Co0.08 Fe0.92 S -","- Co0.64 Fe7.36 S8 -","8","0.666667","","Collin, G.; Comes, R.; Gardette, M.F.","The Fe1-x Cox S system (x< 0.25); transition and the high temperature phase","Journal of Physics and Chemistry of Solids","1987","48","","791","802","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539886","9.873","","9.873","","7.645","","90","","90","","120","","645.366","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","K6 (Mn S4)","","- K6 Mn S4 -","- K6 Mn S4 -","- K12 Mn2 S8 -","2","0.166667","","Bronger, W.; Balk-Hardtdegen, H.","Darstellung, Struktur und magnetisches Verhalten von Alkalimetallmanganchalkogeniden A6 Mn X4 mit A = Na oder K und X = S, Se oder Te","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","574","","89","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539887","9.41","","9.41","","7.273","","90","","90","","120","","557.729","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Na6 (Mn Se4)","","- Mn Na6 Se4 -","- Mn Na6 Se4 -","- Mn2 Na12 Se8 -","2","0.166667","","Bronger, W.; Balk-Hardtdegen, H.","Darstellung, Struktur und magnetisches Verhalten von Alkalimetallmanganchalkogeniden A6 Mn X4 mit A = Na oder K und X = S, Se oder Te","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","574","","89","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539888","10.263","","10.263","","7.885","","90","","90","","120","","719.252","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","K6 (Mn Se4)","","- K6 Mn Se4 -","- K6 Mn Se4 -","- K12 Mn2 Se8 -","2","0.166667","","Bronger, W.; Balk-Hardtdegen, H.","Darstellung, Struktur und magnetisches Verhalten von Alkalimetallmanganchalkogeniden A6 Mn X4 mit A = Na oder K und X = S, Se oder Te","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","574","","89","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539889","10.14","","10.14","","7.748","","90","","90","","120","","689.916","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Na6 (Mn Te4)","","- Mn Na6 Te4 -","- Mn Na6 Te4 -","- Mn2 Na12 Te8 -","2","0.166667","","Bronger, W.; Balk-Hardtdegen, H.","Darstellung, Struktur und magnetisches Verhalten von Alkalimetallmanganchalkogeniden A6 Mn X4 mit A = Na oder K und X = S, Se oder Te","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","574","","89","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539890","10.911","","10.911","","8.387","","90","","90","","120","","864.702","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","K6 (Mn Te4)","","- K6 Mn Te4 -","- K6 Mn Te4 -","- K12 Mn2 Te8 -","2","0.166667","","Bronger, W.; Balk-Hardtdegen, H.","Darstellung, Struktur und magnetisches Verhalten von Alkalimetallmanganchalkogeniden A6 Mn X4 mit A = Na oder K und X = S, Se oder Te","Zeitschrift fuer Anorganische und Allgemeine Chemie","1989","574","","89","98","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1539950","3.8641","","3.8641","","9.9044","","90","","90","","120","","128.072","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ca Cl O H","","- Ca Cl H O -","- Ca Cl O -","- Ca2 Cl2 O2 -","2","0.166667","","Westman, S.; Werner, P.E.; Schuler, T.; Raldow, W.","X-Ray Investigations of Ammines of Alkaline Earth Metal Halides. I. The Structures of Ca Cl2 (N H3)8, Ca Cl2 (N H3)2 and the Decomposition Product Ca Cl O H","Acta Chemica Scandinavica, Series A: (28,1974-)","1981","35","","467","472","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540145","11.0189","","11.0189","","7.0164","","90","","90","","120","","737.771","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ca Ba (Si O4)","","- Ba Ca O4 Si -","- Ba Ca O4 Si -","- Ba8 Ca8 O32 Si8 -","8","0.666667","","Il'inets, A.M.; Bikbau, M.Ya.","Crystal structure of high-temperature alpha-modification of dicalcium silicate","Kristallografiya","1989","34","","1123","1126","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1540290","4.1032","","4.1032","","12.845","","90","","90","","120","","187.288","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","K Sn As","","- As K Sn -","- As K Sn -","- As2 K2 Sn2 -","2","0.166667","","Lii, K.-H.; Haushalter, R.C.","Puckered hexagonal nets in 2-infinite=(Sn3/3 As3/3(-)) and (2-Infinite (Sn3/3 Sb3/3(-))","Journal of Solid State Chemistry","1987","67","","374","378","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1541739","10.512","","10.512","","6.492","","90","","90","","120","","621.269","","","","","","","","","","","","","10","P 63 m c","P 6c -2c","186","","Na1.78 Ca1.34 Sr1.59 Ba.51 La.15 Ce.21 Pr.03 Nd.06 (C O3)5","","- C5 Ba0.51 Ca1.34 Ce0.21 La0.15 Na1.78 Nd0.06 O15 Pr0.03 Sr1.59 -","- C5 Ba0.51 Ca1.341 Ce0.21 La0.15 Na1.779 Nd0.06 O15 Pr0.03 Sr1.59 -","- C10 Ba1.02 Ca2.682 Ce0.42 La0.3 Na3.558 Nd0.12 O30 Pr0.06 Sr3.18 -","2","0.166667","","Effenberger, H.; Kluger, F.; Woelfel, E.R.; Paulus, H.","Crystal structure refinement of burbankite","Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)","1985","1985","","161","170","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1542159","12.993","","12.993","","4.958","","90","","90","","120","","724.863","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ni3 (O H)2 (Te O3)2","","- H2 Ni3 O8 Te2 -","- Ni3 O8 Te2 -","- Ni12 O32 Te8 -","4","0.333333","","Perez, G.; Lasserre, F.; Moret, J.; Maurin, M.","Structure cristalline des hydroxytellurites de nickel et de cobalt","Journal of Solid State Chemistry","1976","17","","143","149","","","","","","","","","","","","","","","","","","","","","","has coordinates","174182","2020-10-21","18:00:00",""
"1542160","13.034","","13.034","","5.016","","90","","90","","120","","737.978","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Co3 (O H)2 (Te O3)2","","- Co3 H2 O8 Te2 -","- Co3 O8 Te2 -","- Co12 O32 Te8 -","4","0.333333","","Perez, G.; Lasserre, F.; Maurin, M.; Moret, J.","Structure cristalline des hydrxytellurites de nickel et de cobalt","Journal of Solid State Chemistry","1976","17","","143","149","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"1544622","5.8052","0.0003","5.8052","0.0003","10.2277","0.0008","90","","90","","120","","298.5","0.03","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","iseite Mn2Mo3O8","","iseite","- Fe0.193 Mn1.787 Mo3.01 O8 -","- Fe0.2 Mn1.8 Mo3 O8 -","- Fe0.4 Mn3.6 Mo6 O16 -","2","0.166667","","Nishio-Hamane, D.; Tomita, N.; Minakawa, T.; Inaba, S.","Iseite, Mn2Mo3O8, a new mineral from Ise, Mie Prefecture, Japan","Journal of Mineralogical and Petrological Sciences","2013","108","","37","41","","","","","","","","","","","","","","","","","","","","","","has coordinates","188566","2020-10-21","18:00:00",""
"1548344","3.19186","0.00002","3.19186","0.00002","5.18498","0.00004","90","","90","","120","","45.7473","0.0005","299","2","299","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ga0.3333 Ge0.3333 N Zn0.3333 -","- Ga0.3333 Ge0.3333 N Zn0.3333 -","- Ga0.6666 Ge0.6666 N2 Zn0.6666 -","2","0.166667","","Suehiro, Takayuki; Tansho, Masataka; Shimizu, Tadashi","Quaternary Wurtzitic Nitrides in the System ZnGeN2‒GaN: Powder Synthesis, Characterization, and Potentiality as a Photocatalyst","The Journal of Physical Chemistry C","2017","121","49","27590","","10.1021/acs.jpcc.7b09135","powder diffraction","","1.54059","CuKα~1~","","0.01336","","","","","","0.01207","0.0237","1.1743","","","","","","","has coordinates","204875","2020-10-21","18:00:00",""
"1557391","3.2771","0.0001","3.2771","0.0001","21.676","0.002","90","","90","","120","","201.6","0.02","","","298","","","","100","","","","","3","P 63 m c","P 6c -2c","186","alpha-Al4SiC4","","","- C4 Al4 Si -","- C4 Al4 Si -","- C8 Al8 Si2 -","2","0.166667","","Inoue, Z.; Inomata, Y.; Tanaka, H.; Kawabata, H.","X-ray crystallographic data on aluminum silicon carbide, alpha-Al4SiC4 and Al4Si2C5","Journal of Materials Science","1980","15","","575","580","","","","","","","","","","","","","","","","","","","","","","has coordinates","248509","2020-10-21","18:00:00",""
"1560335","5.2567","0.0002","5.2567","0.0002","12.2582","0.0003","90","","90","","120","","293.348","0.017","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- Ga H2 K O6 P2 -","- Ga H2 K O6 P2 -","- Ga2 H4 K2 O12 P4 -","2","0.166667","","Hamchaoui, Farida; Alonzo, Véronique; Marlart, Isabelle; Auguste, Sandy; Galven, Cyrille; Rebbah, Houria; Le Fur, Eric","Hydrothermal synthesis, structural and thermal characterizations of three open-framework gallium phosphites","Journal of Solid State Chemistry","2017","255","","8","12","10.1016/j.jssc.2017.07.030","","","0.71069","MoKα","","0.0324","0.023","","","0.049","0.0522","","","","","","0.8","","","","has coordinates","261889","2021-02-11","12:22:19",""
"1560336","5.2576","0.0002","5.2576","0.0002","12.9113","0.0004","90","","90","","120","","309.083","0.019","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- Ga H6 N O6 P2 -","- Ga H6 N O6 P2 -","- Ga2 H12 N2 O12 P4 -","2","0.166667","","Hamchaoui, Farida; Alonzo, Véronique; Marlart, Isabelle; Auguste, Sandy; Galven, Cyrille; Rebbah, Houria; Le Fur, Eric","Hydrothermal synthesis, structural and thermal characterizations of three open-framework gallium phosphites","Journal of Solid State Chemistry","2017","255","","8","12","10.1016/j.jssc.2017.07.030","","","0.71069","MoKα","","0.0292","0.0237","","","0.0537","0.056","","","","","","1.04","","","","has coordinates","261890","2021-02-11","12:23:42",""
"1560337","5.2702","0.0001","5.2702","0.0001","12.7619","0.0005","90","","90","","120","","306.973","0.015","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- Ga H2 O6 P2 Rb -","- Ga H2 O6 P2 Rb -","- Ga2 H4 O12 P4 Rb2 -","2","0.166667","","Hamchaoui, Farida; Alonzo, Véronique; Marlart, Isabelle; Auguste, Sandy; Galven, Cyrille; Rebbah, Houria; Le Fur, Eric","Hydrothermal synthesis, structural and thermal characterizations of three open-framework gallium phosphites","Journal of Solid State Chemistry","2017","255","","8","12","10.1016/j.jssc.2017.07.030","","","0.71069","MoKα","","0.0198","0.0158","","","0.0426","0.0446","","","","","","0.807","","","","has coordinates","261891","2021-02-11","12:24:52",""
"1560546","9.1655","0.0009","9.1655","0.0009","7.0266","0.0013","90","","90","","120","","511.2","0.12","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al Ca3 Na3 P4 -","- Al Ca3 Na3 P4 -","- Al2 Ca6 Na6 P8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0575","0.043","","","0.0827","0.0882","","","","","","1.054","","","","has coordinates","262149","2021-02-23","08:04:31",""
"1560547","9.174","0.002","9.174","0.002","7.035","0.004","90","","90","","120","","512.8","0.3","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ca3 Ga Na3 P4 -","- Ca3 Ga Na3 P4 -","- Ca6 Ga2 Na6 P8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0738","0.0504","","","0.0838","0.0905","","","","","","1.079","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560548","9.358","0.0003","9.358","0.0003","7.1477","0.0005","90","","90","","120","","542.08","0.05","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ca3 In Na3 P4 -","- Ca3 In Na3 P4 -","- Ca6 In2 Na6 P8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0271","0.0261","","","0.079","0.0798","","","","","","1.188","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560549","9.3222","0.0004","9.3222","0.0004","7.288","0.0006","90","","90","","120","","548.5","0.06","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al Eu2.88 Na3.12 P4 -","- Al Eu2.877 Na3.123 P4 -","- Al2 Eu5.754 Na6.246 P8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0094","0.0092","","","0.0209","0.0209","","","","","","1.08","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560550","9.4959","0.0012","9.4959","0.0012","7.3505","0.0018","90","","90","","120","","574.01","0.17","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Eu2.6 In Na3.4 P4 -","- Eu2.598 In Na3.402 P4 -","- Eu5.196 In2 Na6.804 P8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0688","0.0533","","","0.1295","0.135","","","","","","1.147","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560551","9.5114","0.0008","9.5114","0.0008","7.4365","0.0012","90","","90","","120","","582.62","0.12","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- In Na3.25 P4 Sr2.75 -","- In Na3.261 P4 Sr2.739 -","- In2 Na6.522 P8 Sr5.478 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0403","0.0366","","","0.0887","0.0897","","","","","","1.097","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560552","9.4069","0.0009","9.4069","0.0009","7.2039","0.0014","90","","90","","120","","552.07","0.13","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- As4 Ca2.85 Ga Na3.15 -","- As4 Ca2.865 Ga Na3.135 -","- As8 Ca5.73 Ga2 Na6.27 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0366","0.0306","","","0.0505","0.0522","","","","","","1.1","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560553","9.5621","0.0007","9.5621","0.0007","7.4418","0.0011","90","","90","","120","","589.27","0.11","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al As4 Eu2.9 Na3.1 -","- Al As4 Eu2.907 Na3.093 -","- Al2 As8 Eu5.814 Na6.186 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0396","0.0299","","","0.0488","0.0522","","","","","","1.06","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560554","9.5566","0.0012","9.5566","0.0012","7.4319","0.0019","90","","90","","120","","587.81","0.18","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- As4 Eu2.9 Ga Na3.1 -","- As4 Eu2.907 Ga Na3.093 -","- As8 Eu5.814 Ga2 Na6.186 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0424","0.0328","","","0.0693","0.0731","","","","","","1.072","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560555","9.7426","0.0012","9.7426","0.0012","7.605","0.002","90","","90","","120","","625.1","0.2","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- As4 In Na3.34 Sr2.66 -","- As4 In Na3.342 Sr2.658 -","- As8 In2 Na6.684 Sr5.316 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0569","0.0365","","","0.0753","0.0806","","","","","","1.064","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560556","10.0121","0.0005","10.0121","0.0005","7.6045","0.0008","90","","90","","120","","660.16","0.08","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al Ca2.6 Na3.4 Sb4 -","- Al Ca2.49 Na3.51 Sb4 -","- Al2 Ca4.98 Na7.02 Sb8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0417","0.0303","","","0.0495","0.052","","","","","","0.908","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560557","10.1272","0.0005","10.1272","0.0005","7.8453","0.0008","90","","90","","120","","696.82","0.09","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al Eu2.58 Na3.42 Sb4 -","- Al Eu2.583 Na3.417 Sb4 -","- Al2 Eu5.166 Na6.834 Sb8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0162","0.0157","","","0.0396","0.0399","","","","","","1.116","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560558","10.1138","0.0004","10.1138","0.0004","7.8049","0.0006","90","","90","","120","","691.4","0.07","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Eu2.42 Ga Na3.58 Sb4 -","- Eu2.421 Ga Na3.579 Sb4 -","- Eu4.842 Ga2 Na7.158 Sb8 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0267","0.0245","","","0.0501","0.0507","","","","","","1.115","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560559","10.1587","0.001","10.1587","0.001","7.9509","0.0015","90","","90","","120","","710.6","0.17","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al Na3.18 Sb4 Sr2.83 -","- Al Na3.174 Sb4 Sr2.826 -","- Al2 Na6.348 Sb8 Sr5.652 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0146","0.0144","","","0.0331","0.0331","","","","","","1.099","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1560560","10.261","0.0014","10.261","0.0014","7.995","0.002","90","","90","","120","","729","0.2","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- In Na3.45 Sb4 Sr2.55 -","- In Na3.447 Sb4 Sr2.553 -","- In2 Na6.894 Sb8 Sr5.106 -","2","0.166667","","Wang, Yi; Suen, Nian-Tzu; Kunene, Thabiso; Stoyko, Stanislav; Bobev, Svilen","Synthesis and structural characterization of the Zintl phases Na3Ca3TrPn4, Na3Sr3TrPn4, and Na3Eu3TrPn4 (Tr=Al, Ga, In; Pn=P, As, Sb)","Journal of Solid State Chemistry","2017","249","","160","168","10.1016/j.jssc.2017.02.026","","","0.71073","MoKα","","0.0615","0.041","","","0.0808","0.0879","","","","","","1.067","","","","has coordinates","262149","2021-02-23","08:04:32",""
"1562004","12.917","0.002","12.917","0.002","5.0944","0.0007","90","","90","","120","","736.12","0.19","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Co7 H4 O19 V4 -","- Co7 O19 V3.996 -","- Co14 O38 V7.992 -","2","0.166667","","Zhang, Su-Yun; Guo, Wen-Bin; Yang, Ming; Tang, Ying-Ying; Wang, Nan-Nan; Huang, Rong-Rong; Cui, Mei-Yan; He, Zhang-Zhen","Synthesis, crystal structure and magnetic property of a new cobalt(II) vanadate","Journal of Solid State Chemistry","2015","225","","78","82","10.1016/j.jssc.2014.12.004","","","0.71073","MoKα","","0.0492","0.0466","","","0.1136","0.1155","","","","","","1.164","","","","has coordinates","264407","2021-04-22","09:51:37",""
"1562779","5.4693","0.0008","5.4693","0.0008","13.099","0.003","90","","90","","120","","339.34","0.1","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- H5 In O7 P2 -","- H5 In O7 P2 -","- H10 In2 O14 P4 -","2","0.166667","","Li, Huiduan; Zhang, Lirong; Huo, Qisheng; Liu, Yunling","Construction of two novel indium phosphites with (3,6)- and (3,5)-connected frameworks: Synthesis, structure and characterization","Journal of Solid State Chemistry","2013","197","","75","80","10.1016/j.jssc.2012.09.017","","","0.71073","MoKα","","0.0138","0.0135","","","0.0327","0.0327","","","","","","1.293","","","","has coordinates","265411","2021-05-21","08:22:20",""
"1563737","5.7693","0.0003","5.7693","0.0003","9.907","0.0007","90","","90","","120","","285.57","0.03","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Co2 Mo3 O8 -","- Co2 Mo3 O8 -","- Co4 Mo6 O16 -","2","0.166667","","Abe, Hideki; Sato, Akira; Tsujii, Naohito; Furubayashi, Takao; Shimoda, Masahiko","Structural refinement of T2Mo3O8 (T=Mg, Co, Zn and Mn) and anomalous valence of trinuclear molybdenum clusters in Mn2Mo3O8","Journal of Solid State Chemistry","2010","183","2","379","384","10.1016/j.jssc.2009.11.024","","","0.71073","MoKα","","0.0189","0.0186","","","0.0443","0.0444","","","","","","1.139","","","","has coordinates","266736","2021-06-28","09:52:09",""
"1563738","5.7628","0.0001","5.7628","0.0001","9.877","0.0003","90","","90","","120","","284.068","0.011","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mg2 Mo3 O8 -","- Mg2 Mo3 O8 -","- Mg4 Mo6 O16 -","2","0.166667","","Abe, Hideki; Sato, Akira; Tsujii, Naohito; Furubayashi, Takao; Shimoda, Masahiko","Structural refinement of T2Mo3O8 (T=Mg, Co, Zn and Mn) and anomalous valence of trinuclear molybdenum clusters in Mn2Mo3O8","Journal of Solid State Chemistry","2010","183","2","379","384","10.1016/j.jssc.2009.11.024","","","0.71073","MoKα","","0.0273","0.0269","","","0.056","0.0562","","","","","","1.145","","","","has coordinates","266736","2021-06-28","09:52:10",""
"1563739","5.8003","0.0002","5.8003","0.0002","10.2425","0.0005","90","","90","","120","","298.43","0.02","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mn2 Mo3 O8 -","- Mn2 Mo3 O8 -","- Mn4 Mo6 O16 -","2","0.166667","","Abe, Hideki; Sato, Akira; Tsujii, Naohito; Furubayashi, Takao; Shimoda, Masahiko","Structural refinement of T2Mo3O8 (T=Mg, Co, Zn and Mn) and anomalous valence of trinuclear molybdenum clusters in Mn2Mo3O8","Journal of Solid State Chemistry","2010","183","2","379","384","10.1016/j.jssc.2009.11.024","","","0.71073","MoKα","","0.0355","0.0352","","","0.0857","0.0859","","","","","","1.154","","","","has coordinates","266736","2021-06-28","09:52:10",""
"1563740","5.7835","0.0002","5.7835","0.0002","9.8996","0.0005","90","","90","","120","","286.77","0.02","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mo3 O8 Zn2 -","- Mo3 O8 Zn2 -","- Mo6 O16 Zn4 -","2","0.166667","","Abe, Hideki; Sato, Akira; Tsujii, Naohito; Furubayashi, Takao; Shimoda, Masahiko","Structural refinement of T2Mo3O8 (T=Mg, Co, Zn and Mn) and anomalous valence of trinuclear molybdenum clusters in Mn2Mo3O8","Journal of Solid State Chemistry","2010","183","2","379","384","10.1016/j.jssc.2009.11.024","","","0.71073","MoKα","","0.027","0.0267","","","0.0672","0.0673","","","","","","1.092","","","","has coordinates","266736","2021-06-28","09:52:10",""
"1563907","5.696","0.004","5.696","0.004","9.387","0.004","90","","90","","120","","263.8","0.3","293","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ga1.069 O8 V3.931 -","- Ga1.069 O8 V3.931 -","- Ga2.138 O16 V7.862 -","2","0.166667","","Aguilar-Maldonado, Cintli; Mentré, Olivier; Tsirlin, Alexander A.; Ritter, Clemens; Missiul, Aleksandr; Fauth, Francois; Arévalo-López, Angel M.","Hybrid electrons in the trimerized GaV4O8","Materials Horizons","2021","8","8","2325","2329","10.1039/D1MH00390A","","x-ray","0.56087","AgKα","","0.0344","0.0238","","","0.0449","0.0485","","","","1.19","1.19","1.18","","","","has coordinates","268967","2021-09-06","12:41:54",""
"1568976","22.0822","0.0004","22.0822","0.0004","6.1544","0.0002","90","","90","","120","","2598.97","0.11","293","2","293","2","","","","","","","","7","P 63 m c","P 6c -2c","186","Rb3K6Li2Mn4Ga12S27Cl1","","","- Cl Ga12 K6 Li2 Mn4 Rb3 S27 -","- Cl Ga12 K6 Li2.0001 Mn3.9999 Rb3 S27 -","- Cl2 Ga24 K12 Li4.0002 Mn7.9998 Rb6 S54 -","2","0.166667","","Pei, Shao-Min; Liu, Bin-Wen; Chen, Wen-Fa; Jiang, Xiao-Ming; Guo, Guo-Cong","Breaking the bottleneck of simultaneously wide band gap and large nonlinear optical coefficient by a ""pore reconstruction"" strategy in a salt-inclusion chalcogenide.","Materials horizons","2023","10","8","2921","2926","10.1039/d3mh00389b","","","0.71073","MoKα","","0.0617","0.0573","","","0.1829","0.1883","","","","","","1.064","","","","has coordinates","285538","2023-08-05","09:39:00",""
"2001426","7.8723","0.0005","7.8723","0.0005","5.499","0.001","90","","90","","120","","295.13","0.06","296","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Br H6 Li O7 -","- Br H6 Li O7 -","- Br2 H12 Li2 O14 -","2","0.166667","CR1039","Blackburn, A. C.; Gallucci, J. C.; Gerkin, R. E.; Reppart, W. J.","Structure of lithium perbromate trihydrate","Acta Crystallographica Section C","1993","49","8","1437","1439","10.1107/S0108270193000538","","","0.71073","MoKα","","","0.037","","","0.057","","","","","2.55","2.55","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002156","11.7191","0.001","11.7191","0.001","6.847","0.001","90","","90","","120","","814.4","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Tetrabarium tetraneodymium trizinc platinum oxide","","- Ba4 Nd4 O15 Pt Zn3 -","- Ba4 Nd4 O15 Pt Zn3 -","- Ba8 Nd8 O30 Pt2 Zn6 -","2","0.166667","","Sfreddo, O; Mueller-Buschbaum, Hk","Weitere Verbindungen zum Ba6 Nd2 Al4 O15-Typ: Ba4 Nd4 Zn3 Pt O15 und Ba4 Eu4 Zn3 Pt O15","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1998","53","","628","630","","","","","","","0.0288","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002157","11.6542","0.001","11.6542","0.001","6.7776","0.001","90","","90","","120","","797.2","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Tetrabarium tetraeuropium trizinc platinum oxide","","- Ba4 Eu4 O15 Pt Zn3 -","- Ba4 Eu4 O15 Pt Zn3 -","- Ba8 Eu8 O30 Pt2 Zn6 -","2","0.166667","","Sfreddo, O; Mueller-Buschbaum, Hk","Weitere Verbindungen zum Ba6 Nd2 Al4 O15-Typ: Ba4 Nd4 Zn3 Pt O15 und Ba4 Eu4 Zn3 Pt O15","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1998","53","","628","630","","","","","","","0.0419","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002158","6.342","0.001","6.342","0.001","10.282","0.001","90","","90","","120","","358.1","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Barium diindium trizinc oxide","","- Ba In2 O7 Zn3 -","- Ba In2 O7 Zn3 -","- Ba2 In4 O14 Zn6 -","2","0.166667","","Sfreddo, O; Mueller-Buschbaum, Hk","Indium partiell in tetraedrischer Sauerstoffkoordination in Ba In2 Zn3 O7. Eine Betrachtung zum Ba2 Ln2 Zn8 O13/ Ba Ln Al Zn3 O7 - Typ","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1998","53","","517","520","","","","","","","0.0452","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002447","11.814","0.001","11.814","0.001","7.1003","0.0006","90","","90","","120","","858.2","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium lanthanum aluminium iron(III) oxide (6/2/1.5/2.5/15)","","- Al1.5 Ba6 Fe2.5 La2 O15 -","- Al1.5 Ba5.99 Fe2.5 La2.01 O15 -","- Al3 Ba11.98 Fe5 La4.02 O30 -","2","0.166667","","Rueter, I; Mueller-Buschbaum, Hk","Geordnete Oktaederbesetzung in Ba6 La2 Al1.5 Fe2.5 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","588","","97","101","10.1002/zaac.19905880112","","","","","","0.046","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002450","11.5696","0.0011","11.5696","0.0011","6.9662","0.0015","90","","90","","120","","807.5","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Hexabarium dineodymium tetraaluminium oxide","","- Al4 Ba6 Nd2 O15 -","- Al4 Ba5.99 Nd2.01 O15 -","- Al8 Ba11.98 Nd4.02 O30 -","2","0.166667","","Rueter, I; Mueller-Buschbaum, Hk","Ein neuer Strukturtyp mit flaechenverknuepften Ba O6 Oktaedern: Ba6 Nd2 Al4 O15","Monatshefte fuer Chemie und verwandte Teile anderer Wissenschaften (109,1978-)","1989","120","","1069","1074","","","","","","","0.029","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002456","11.815","0.005","11.815","0.005","7.078","0.002","90","","90","","120","","855.7","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Hexabarium dineodymium tetrairon(III) oxide","","- Ba6 Fe4 Nd2 O15 -","- Ba5.99 Fe4 Nd2.01 O15 -","- Ba11.98 Fe8 Nd4.02 O30 -","2","0.166667","","Mevs, H; Mueller-Buschbaum, Hk","Neue Verbindungen mit Ba6 Ln2 (M3+)4 O15-Typ: Ba6 Nd2 Fe4 O15, Ba5 Sr La2 Fe4 O15 und Ba5 Sr Nd2 Fe4 O15","Journal of the Less-Common Metals","1990","158","","147","152","10.1016/0022-5088(90)90441-L","","","","","","0.042","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002457","11.819","0.002","11.819","0.002","7.052","0.002","90","","90","","120","","853.1","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium strontium dilanthanum tetrairon(III) oxide","","- Ba5 Fe4 La2 O15 Sr -","- Ba5 Fe4 La2.01 O15 Sr0.99 -","- Ba10 Fe8 La4.02 O30 Sr1.98 -","2","0.166667","","Mevs, H; Mueller-Buschbaum, Hk","Neue Verbindungen mit Ba6 Ln2 (M3+)4 O15-Typ: Ba6 Nd2 Fe4 O15, Ba5 Sr La2 Fe4 O15 und Ba5 Sr Nd2 Fe4 O15","Journal of the Less-Common Metals","1990","158","","147","152","10.1016/0022-5088(90)90441-L","","","","","","0.052","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002458","11.73","0.007","11.73","0.007","7.015","0.004","90","","90","","120","","835.9","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium strontium dineodymium tetrairon(III) oxide","","- Ba5 Fe4 Nd2 O15 Sr -","- Ba5 Fe4 Nd2.01 O15 Sr0.99 -","- Ba10 Fe8 Nd4.02 O30 Sr1.98 -","2","0.166667","","Mevs, H; Mueller-Buschbaum, Hk","Neue Verbindungen mit Ba6 Ln2 (M3+)4 O15-Typ: Ba6 Nd2 Fe4 O15, Ba5 Sr La2 Fe4 O15 und Ba5 Sr Nd2 Fe4 O15","Journal of the Less-Common Metals","1990","158","","147","152","10.1016/0022-5088(90)90441-L","","","","","","0.047","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002492","11.6244","0.0006","11.6244","0.0006","6.9205","0.0005","90","","90","","120","","809.9","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium calcium neodymium iron oxide (4.5/1.5/2/4/15)","","- Ba4.5 Ca1.5 Fe4 Nd2 O15 -","- Ba4.5 Ca1.499 Fe4 Nd2.001 O15 -","- Ba9 Ca2.998 Fe8 Nd4.002 O30 -","2","0.166667","","Rueter, I; Mueller-Buschbaum, Hk","Zur Kristallchemie von Oxometallaten der Zusammensetzung Ba6 Nd2 Al4 O15: neue Ergebnisse an Ba4.5 Ca1.5 Nd2 Fe4 O5 und Ba5 Ca Sm2 Fe4 O15","Journal of the Less-Common Metals","1990","162","","175","180","10.1016/0022-5088(90)90472-V","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002493","11.655","0.001","11.655","0.001","6.987","0.003","90","","90","","120","","822","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium calcium samarium iron oxide (5/1/2/4/15)","","- Ba5 Ca Fe4 O15 Sm2 -","- Ba4.998 Ca0.998 Fe4 O15 Sm2.001 -","- Ba9.996 Ca1.996 Fe8 O30 Sm4.002 -","2","0.166667","","Rueter, I; Mueller-Buschbaum, Hk","Zur Kristallchemie von Oxometallaten der Zusammensetzung Ba6 Nd2 Al4 O15: neue Ergebnisse an Ba4.5 Ca1.5 Nd2 Fe4 O5 und Ba5 Ca Sm2 Fe4 O15","Journal of the Less-Common Metals","1990","162","","175","180","10.1016/0022-5088(90)90472-V","","","","","","0.045","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002521","11.8082","0.0029","11.8082","0.0029","7.0019","0.008","90","","90","","120","","845.5","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Hexabarium dilanthanum tetracobalt(III) oxide","","- Ba6 Co4 La2 O15 -","- Ba5.999 Co4 La2.001 O15 -","- Ba11.998 Co8 La4.002 O30 -","2","0.166667","","Mevs, H; Mueller-Buschbaum, Hk","Zur Kenntnis von Ba6 La2 Co4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","584","","114","118","10.1002/zaac.19905840109","","","","","","0.056","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002549","5.9941","0.0014","5.9941","0.0014","9.9538","0.0023","90","","90","","120","","309.7","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Copper zinc aluminium tantalum oxide (1.3/2.7/1/1/8)","","- Al Cu1.333 O8 Ta Zn2.667 -","- Al Cu1.333 O8 Ta Zn2.667 -","- Al2 Cu2.666 O16 Ta2 Zn5.334 -","2","0.166667","","Harneit, O; Mueller-Buschbaum, Hk","Ein Oxometallat mit dem Strukturtyp der hexagonalen Tieftemperaturform von Li Fe Sn O4: (Cu, Zn)4 Al Ta O8","Journal of Alloys Compd.","1992","184","","323","328","10.1016/0925-8388(92)90506-5","","","","","","0.065","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002568","11.77","0.001","11.77","0.001","7.039","0.003","90","","90","","120","","844.5","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium calcium lanthanum iron(III) oxide (5/1/2/4/15)","","- Ba4.975 Ca1.025 Fe4 La2 O15 -","- Ba4.975 Ca1.024 Fe4 La2.001 O15 -","- Ba9.95 Ca2.048 Fe8 La4.002 O30 -","2","0.166667","","Rueter, I; Mueller-Buschbaum, Hk","Eine partiell statistische Einlagerung von Ca2+ in den Ba6 Nd2 Al4 O15- Typ. Ba5 Ca La2 Fe4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1990","585","","82","86","10.1002/zaac.19905850110","","","","","","0.041","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002594","11.6771","0.0042","11.6771","0.0042","6.9593","0.005","90","","90","","120","","821.8","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium calcium lanthanum iron(III) oxide (4.5/1.5/2/4/15)","","- Ba4.5 Ca1.5 Fe4 La2 O15 -","- Ba4.5 Ca1.4999 Fe4 La2.0001 O15 -","- Ba9 Ca2.9998 Fe8 La4.0002 O30 -","2","0.166667","","Mueller-Buschbaum, Hk; Martin, F - D","Synthese und Kristallstruktur von Ba4.5 Ca1.5 La2 Fe4 O15, Ba5 Ca Eu2 Fe4 O15 und Ba5 Ca Nd2 Co4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1992","617","","84","88","10.1002/zaac.19926170113","","","","","","0.06","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002595","11.5701","0.0023","11.5701","0.0023","6.8916","0.0055","90","","90","","120","","799","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium calcium dieuropium tetrairon(III) oxide","","- Ba5 Ca Eu2 Fe4 O15 -","- Ba5.0001 Ca1.0001 Eu2.0001 Fe4 O15 -","- Ba10.0002 Ca2.0002 Eu4.0002 Fe8 O30 -","2","0.166667","","Mueller-Buschbaum, Hk; Martin, F - D","Synthese und Kristallstruktur von Ba4.5 Ca1.5 La2 Fe4 O15, Ba5 Ca Eu2 Fe4 O15 und Ba5 Ca Nd2 Co4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1992","617","","84","88","10.1002/zaac.19926170113","","","","","","0.053","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002596","11.6043","0.0019","11.6043","0.0019","6.8389","0.0027","90","","90","","120","","797.5","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium calcium dineodymium tetracobalt(III) oxide","","- Ba5 Ca Co4 Nd2 O15 -","- Ba5.0001 Ca1.0001 Co4 Nd2.0001 O15 -","- Ba10.0002 Ca2.0002 Co8 Nd4.0002 O30 -","2","0.166667","","Mueller-Buschbaum, Hk; Martin, F - D","Synthese und Kristallstruktur von Ba4.5 Ca1.5 La2 Fe4 O15, Ba5 Ca Eu2 Fe4 O15 und Ba5 Ca Nd2 Co4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1992","617","","84","88","10.1002/zaac.19926170113","","","","","","0.085","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002613","11.506","0.0022","11.506","0.0022","6.8715","0.001","90","","90","","120","","787.8","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium samarium cobalt aluminium oxide (6/2/2.5/1.5/15)","","- Al1.5 Ba6 Co2.5 O15 Sm2 -","- Al1.5 Ba5.9999 Co2.5 O15 Sm2.0001 -","- Al3 Ba11.9998 Co5 O30 Sm4.0002 -","2","0.166667","","Abed, M; Mueller-Buschbaum, Hk","Zur Kristallstruktur von Ba6 Sm2 Co2.5 Al1.5 O15","Journal of Alloys Compd.","1993","198","","L9","L10","10.1016/0925-8388(93)90132-7","","","","","","0.086","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002616","11.16","0.0013","11.16","0.0013","12.4283","0.0019","90","","90","","120","","1340.5","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Potassium tribarium tetracalcium tricopper heptavanadate","","- Ba3 Ca4 Cu3 K O28 V7 -","- Ba3 Ca4 Cu3 K O28 V7 -","- Ba6 Ca8 Cu6 K2 O56 V14 -","2","0.166667","","Postel, M von; Mueller-Buschbaum, Hk","Ein neues Alkali-Erdalkalimetall-Kupfer-Oxovanadat: K Ba3 Ca4 Cu3 V7 O28","Zeitschrift fuer Anorganische und Allgemeine Chemie","1993","619","","123","127","10.1002/zaac.19936190120","","","","","","0.087","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002630","11.1751","0.0008","11.1751","0.0008","12.434","0.002","90","","90","","120","","1344.8","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Rubidium calcium barium copper vanadium oxide (0.5/4.3/3/3/7/28)","","- Ba3 Ca4.25 Cu3 O28 Rb0.5 V7 -","- Ba3 Ca4.25 Cu3 O28 Rb0.5 V7 -","- Ba6 Ca8.5 Cu6 O56 Rb V14 -","2","0.166667","","Postel, M von; Mueller-Buschbaum, Hk","Zur Kenntnis von Rb Ba3 Ca4 Cu3 V7 O28","Journal of Alloys Compd.","1993","200","","165","169","10.1016/0925-8388(93)90488-9","","","","","","0.076","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002726","11.814","0.0014","11.814","0.003","7.1","0.002","90","","90","","120","","858.2","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Hexabarium dipraseodymium tetracobalt(III) oxide","","- Ba6 Co4 O15 Pr2 -","- Ba5.99 Co4 O15 Pr2.01 -","- Ba11.98 Co8 O30 Pr4.02 -","2","0.166667","","Mueller-Buschbaum, Hk; Uensal, H","Zur Kenntnis von Ba6 Pr2 Co4 O15 und Ba5 Sr Pr2 Co4 O15","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","453","455","","","","","","","0.0282","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002727","11.6457","0.0008","11.6457","0.0008","6.8601","0.0011","90","","90","","120","","805.7","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium strontium diraseodymium tetracobalt(III) oxide","","- Ba5 Co4 O15 Pr2 Sr -","- Ba5.001 Co4 O15 Pr1.998 Sr1.001 -","- Ba10.002 Co8 O30 Pr3.996 Sr2.002 -","2","0.166667","","Mueller-Buschbaum, Hk; Uensal, H","Zur Kenntnis von Ba6 Pr2 Co4 O15 und Ba5 Sr Pr2 Co4 O15","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","453","455","","","","","","","0.0251","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002754","6.237","0.002","6.237","0.002","10.161","0.003","90","","90","","120","","342.3","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium lutetium aluminium zinc oxide (1/1/0.91/3.1/7)","","- Al0.91 Ba Lu O7 Zn3.09 -","- Al0.9086 Ba Lu O7 Zn3.0914 -","- Al1.8172 Ba2 Lu2 O14 Zn6.1828 -","2","0.166667","","Mueller-Buschbaum, Hk; Rabbow, C","Zur Kenntnis eines Barium-Lanthanoid-Aluminat-Zinkats: Ba Lu Al Zn3 O7 mit einem Anhang zu Ba2 Er2 Zn8 O13.","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","343","347","","","","","","","0.0209","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2002755","6.276","0.002","6.276","0.002","10.195","0.003","90","","90","","120","","347.8","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Barium erbium zinc oxide (2/2/8/13.04)","","- Ba2 Er2 O13.04 Zn8 -","- Ba2 Er2 O13.04 Zn8 -","- Ba2 Er2 O13.04 Zn8 -","1","0.0833333","","Mueller-Buschbaum, Hk; Rabbow, C","Zur Kenntnis eines Barium-Lanthanoid-Aluminat-Zinkats: Ba Lu Al Zn3 O7 mit einem Anhang zu Ba2 Er2 Zn8 O13.","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","343","347","","","","","","","0.0546","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002758","11.6571","0.001","11.6571","0.001","6.7888","0.001","90","","90","","120","","798.9","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Barium samarium zinc platinum oxide (4/4/3/1/15)","","- Ba4 O15 Pt Sm4 Zn3 -","- Ba4 O15 Pt Sm4 Zn3 -","- Ba8 O30 Pt2 Sm8 Zn6 -","2","0.166667","","Mueller-Buschbaum, Hk; Rabbow, C; Sfreddo, O","Eine neue Verbindung im System Ba/Ln/Zn/Pt/O der Zusammensetzung: Ba4 Sm4 Zn3 Pt O15","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1996","51","","338","342","","","","","","","0.0384","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002796","11.808","0.002","11.808","0.004","7.036","0.004","90","","90","","120","","849.6","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Hexabarium dipraseodymium tetrairon(III) oxide","","- Ba6 Fe4 O15 Pr2 -","- Ba5.9999 Fe4 O15 Pr2.0001 -","- Ba11.9998 Fe8 O30 Pr4.0002 -","2","0.166667","","Mueller-Buschbaum, Hk; Meyer, S","Zur Kenntnis von Ba6 Pr2 Fe4 O15, Ba5 Sr Pr2 Fe4 O15 und Ba5 Ca Pr2 Fe4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1997","623","","200","204","10.1002/zaac.19976230133","","","","","","0.0402","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002797","11.602","0.006","11.602","0.006","6.894","0.005","90","","90","","120","","803.7","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium calcium dipraseodymium tetrairon(III) oxide","","- Ba5 Ca Fe4 O15 Pr2 -","- Ba5.0001 Ca1.0001 Fe4 O15 Pr2.0001 -","- Ba10.0002 Ca2.0002 Fe8 O30 Pr4.0002 -","2","0.166667","","Mueller-Buschbaum, Hk; Meyer, S","Zur Kenntnis von Ba6 Pr2 Fe4 O15, Ba5 Sr Pr2 Fe4 O15 und Ba5 Ca Pr2 Fe4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1997","623","","200","204","10.1002/zaac.19976230133","","","","","","0.055","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002798","11.689","0.002","11.689","0.002","6.954","0.002","90","","90","","120","","822.8","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Pentabarium strontium dipraseodymium tetrairon(III) oxide","","- Ba5 Fe4 O15 Pr2 Sr -","- Ba5.0001 Fe4 O15 Pr2.0001 Sr1.0001 -","- Ba10.0002 Fe8 O30 Pr4.0002 Sr2.0002 -","2","0.166667","","Mueller-Buschbaum, Hk; Meyer, S","Zur Kenntnis von Ba6 Pr2 Fe4 O15, Ba5 Sr Pr2 Fe4 O15 und Ba5 Ca Pr2 Fe4 O15","Zeitschrift fuer Anorganische und Allgemeine Chemie","1997","623","","200","204","10.1002/zaac.19976230133","","","","","","0.0457","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002820","6.3464","0.0007","6.3464","0.0007","10.237","0.003","90","","90","","120","","357.1","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","Aluminium barium samarium zinc oxide (1.1/1/1/2.9/7)","","- Al1.078 Ba O7 Sm Zn2.922 -","- Al1.078 Ba O7 Sm Zn2.922 -","- Al2.156 Ba2 O14 Sm2 Zn5.844 -","2","0.166667","","Mueller-Buschbaum, Hk; Rabbow, C; Panzer, S","Roentgenstrukturanalyse von zwei Verbindungen des Kupfertyps Ba M Ln2 O5 (M= Zn, Ln= Sm, Tm) und von Ba Sm Al Zn3 O7","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","1997","52","","546","548","","","","","","","0.0404","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2002846","11.904","0.01","11.904","0.01","7.111","0.002","90","","90","","120","","872.7","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Barium lanthanum iron oxide (6/2/4/15)","","- Ba6 Fe4 La2 O15 -","- Ba5.99 Fe4 La2.01 O15 -","- Ba11.98 Fe8 La4.02 O30 -","2","0.166667","","Mevs, H; Mueller-Buschbaum, Hk","Ba6 La2 Fe4 O15: Ein Oxymetallat mit einem neuen Strukturtyp","Journal of the Less-Common Metals","1990","157","","173","178","10.1016/0022-5088(90)90418-J","","","","","","0.032","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2006836","5.9822","0.0003","5.9822","0.0003","9.7455","0.0004","90","","90","","120","","302.03","0.02","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","Europium ytterbium nitridosilicate","Europium-ytterbium-tetrasiliconheptanitride","","- Eu N7 Si4 Yb -","- Eu N7 Si4 Yb -","- Eu2 N14 Si8 Yb2 -","2","0.166667","JZ1226","Huppertz, Hubert; Schnick, Wolfgang","Eu~2~Si~5~N~8~ and EuYbSi~4~N~7~. The First Nitridosilicates with a Divalent Rare Earth Metal","Acta Crystallographica Section C","1997","53","12","1751","1753","10.1107/S0108270197008767","","","0.71073","MoKα","","0.0261","0.0212","","0.0491","0.0478","","","","1.068","1.091","1.091","","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2008538","6.142","0.001","6.142","0.001","14.395","0.002","90","","90","","120","","470.29","0.13","295","2","295","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","potassium oxo antimonide","","- K4 O3 Sb2 -","- K4 O3 Sb2 -","- K8 O6 Sb4 -","2","0.166667","BR1231","Tillard, Monique; Monconduit, Laure; Traber, Boris; Belin, Claude","K~4~Sb~2~O~3~ containing the Sb~2~O~3~^4-^ anion","Acta Crystallographica Section C","1999","55","6","833","835","10.1107/S0108270198018484","","","0.71073","MoKα","","0.086","0.048","","","","0.126","","","","","","1.133","","","","has coordinates","176759","2020-10-21","18:00:00",""
"2009845","12.9994","0.0008","12.9994","0.0008","5.0932","0.0003","90","","90","","120","","745.36","0.08","293","","293","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Iron Hydroxyphosphite","","- Fe11 H14 O30 P8 -","- Fe10.992 H8 O30 P8 -","- Fe10.992 H8 O30 P8 -","1","0.0833333","BR1071","Attfield, Martin P.; Morris, Russell E.; Cheetham, Anthony K.","Synthesis and structures of two isostructural phosphites, Fe~11~(HPO~3~)~8~(OH)~6~ and Mn~11~(HPO~3~)~8~(OH)~6~","Acta Crystallographica Section C","1994","50","7","981","984","10.1107/S0108270194001368","","","1.5418","CuKα","","","0.0243","","","0.0283","","","","","","","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2009846","13.1957","0.0006","13.1957","0.0006","5.177","0.0003","90","","90","","120","","780.68","0.07","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Manganese Hydroxyphosphite","","- H14 Mn11 O30 P8 -","- H8 Mn10.908 O30 P8 -","- H8 Mn10.908 O30 P8 -","1","0.0833333","BR1071","Attfield, Martin P.; Morris, Russell E.; Cheetham, Anthony K.","Synthesis and structures of two isostructural phosphites, Fe~11~(HPO~3~)~8~(OH)~6~ and Mn~11~(HPO~3~)~8~(OH)~6~","Acta Crystallographica Section C","1994","50","7","981","984","10.1107/S0108270194001368","","","","","","","","","","","","","","","","","","","","","has coordinates","192027","2020-10-21","18:00:00",""
"2010024","3.901","0.002","3.901","0.002","29.35","0.04","90","","90","","120","","386.8","0.6","293","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ca K0.5 S4 Yb1.833 -","- Ca K0.5 S4 Yb1.833 -","- Ca2 K S8 Yb3.666 -","2","0.166667","DU1053","El Fadli, Z.; Lemoine, P.; Tomas, A.; Guittard, M.","Sulfure d'ytterbium, de calcium et de potassium, CaK~0,5~Yb~1,833~S~4~","Acta Crystallographica Section C","1994","50","9","1373","1375","10.1107/S010827019400137X","","","0.71069","MoKα","","","0.0427","","","0.059","","","","","0.32","0.32","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2010275","11.288","0.007","11.288","0.007","8.013","0.002","90","","90","","120","","884.2","0.8","298","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Cl In K6 Te4 -","- Cl In K6 Te4 -","- Cl2 In2 K12 Te8 -","2","0.166667","DU1081","Sportouch, S.; Belin, C.; Tillard-Charbonnel, M.","K~5~InTe~4~.KCl","Acta Crystallographica Section C","1994","50","12","1861","1862","10.1107/S0108270194006141","","","0.7107","MoKα","","","0.0181","","","0.0227","","","","","0.912","0.912","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2012011","5.0976","0.0003","5.0976","0.0003","8.3441","0.0004","90","","90","","120","","187.77","0.02","593","","593","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Al O4 P -","- Al O4 P -","- Al2 O8 P2 -","2","0.166667","","Graetsch, Heribert A.","Hexagonal high-temperature form of AlPO~4~ tridymite, from X-ray powder data","Acta Crystallographica, Section C","2001","57","","665","667","10.1107/S0108270101005133","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2012012","5.0976","0.0003","5.0976","0.0003","8.3441","0.0004","90","","90","","120","","187.77","0.02","593","","593","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Al O4 P -","- Al O4.00008 P -","- Al2 O8.00016 P2 -","2","0.166667","","Graetsch, Heribert A.","Hexagonal high-temperature form of AlPO~4~ tridymite, from X-ray powder data","Acta Crystallographica, Section C","2001","57","","665","667","10.1107/S0108270101005133","","","","","","","","","","","","","","","","","","","","","has coordinates","277836","2022-09-14","17:02:02",""
"2013741","10.404","0.002","10.404","0.002","7.996","0.003","90","","90","","120","","749.6","0.3","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","europium(II) oxyiodide","tetraeuropium hexaiodine oxygen","","- Eu4 I6 O -","- Eu4 I6 O -","- Eu8 I12 O2 -","2","0.166667","BC1033","Liao, Wuping; Dronskowski, Richard","Europium(II) oxyiodide","Acta Crystallographica Section C","2004","60","3","i23","i24","10.1107/S0108270103028671","","","0.71073","MoKα","","0.0281","0.0267","","","0.0658","0.0667","","","","","","1.093","","","","has coordinates,has Fobs","176760","2020-10-21","18:00:00",""
"2017527","8.2533","0.0004","8.2533","0.0004","6.3196","0.0004","90","","90","","120","","372.8","0.03","298","","298","","","","","","","","","3","P 63 m c","P 6c -2c","186","","tripotassium octafluorotantalate","","- F8 K3 Ta -","- F8 K3 Ta -","- F16 K6 Ta2 -","2","0.166667","SQ3230","Smrčok, Ľubomír; Černý, Radovan; Boča, Miroslav; Macková, Iveta; Kubíková, Blanka","K~3~TaF~8~ from laboratory X-ray powder data","Acta Crystallographica Section C","2010","66","2","i16","i18","10.1107/S0108270109055140","powder diffraction","","1.78892","","","","","","","","","","","","","","","","","","has coordinates","176760","2020-10-21","18:00:00",""
"2017880","5.7702","0.0001","5.7702","0.0001","13.0784","0.0003","90","","90","","120","","377.109","0.013","295","","295","","","","","","","","","3","P 63 m c","P 6c -2c","186","","strontium haxavanadium undecaoxide","","- O11 Sr V6 -","- O11 Sr V6 -","- O22 Sr2 V12 -","2","0.166667","FA3226","Hata, Yoshiaki; Kanke, Yasushi; Kita, Eiji","The structural phase transition in SrV~6~O~11~","Acta Crystallographica Section C","2010","66","12","i99","i102","10.1107/S0108270110046299","","","0.71073","MoKα","","0.0216","0.0216","","","0.0548","0.0549","","","","","","1.205","","","","has coordinates,has Fobs","176432","2020-10-21","18:00:00",""
"2019519","8.2154","0.0004","8.2154","0.0004","13.1972","0.0008","90","","90","","120","","771.38","0.07","290","2","290","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","Tetraethylammonium tetrachloridoferrate(III)","","- C8 H20 Cl4 Fe N -","- C8.0016 H20.004 Cl4 Fe N -","- C16.0032 H40.008 Cl8 Fe2 N2 -","2","0.166667","GZ3264","Lutz, Martin; Huang, Yuxing; Moret, Marc-Etienne; Klein Gebbink, Robertus J. M.","Phase transitions and twinned low-temperature structures of tetraethylammonium tetrachloridoferrate(III)","Acta Crystallographica Section C","2014","70","5","470","476","10.1107/S2053229614007955","","","0.71073","MoKα","","0.0268","0.0231","","","0.0624","0.0652","","","","","","1.086","","","","has coordinates,has disorder,has Fobs","176760","2020-10-21","18:00:00",""
"2021185","6.9809","0.0007","6.9809","0.0007","12.027","0.0009","90","","90","","120","","507.59","0.08","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","Caesium manganese hexahydrate phosphate","Caesium manganese hexahydrate phosphate","","- Cs H12 Mn O10 P -","- Cs H12 Mn O10 P -","- Cs2 H24 Mn2 O20 P2 -","2","0.166667","FN3263","Kiriukhina, Galina V.; Yakubovich, Olga V.; Kochetkova, Ekaterina M.; Dimitrova, Olga V.; Volkov, Anatoliy S.","A first Mn member in the struvite morphotropic series, CsMn(H~2~O)~6~(PO~4~): hydrothermal synthesis, crystal structure and interconnections within the family of related phosphates","Acta Crystallographica Section C","2018","74","8","","","10.1107/S2053229618009798","","","0.71073","MoKα","","0.0378","0.0328","","","0.0639","0.0656","","","","","","1.157","","","","has coordinates,has Fobs","209162","2020-10-21","18:00:00",""
"2021972","8.15","0.002","8.15","0.003","13.092","0.003","90","","90","","120","","753.1","0.4","297","2","297","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","Tetraethylammonium tetrathiorhenate","","- C8 H20 N Re S4 -","- C8.0016 H20.004 N1.0002 Re S4 -","- C16.0032 H40.008 N2.0004 Re2 S8 -","2","0.166667","EF3002","Bernhardt, Eduard; Herbst-Irmer, Regine","Phase transition and structures of the twinned low-temperature phases of (Et~4~N)[ReS~4~]","Acta Crystallographica Section C","2020","76","3","","","10.1107/S205322961901725X","","","0.71073","MoKα","","0.0333","0.0208","","","0.0429","0.0475","","","","","","1.084","","","","has coordinates,has disorder,has Fobs","247978","2020-10-21","18:00:00",""
"2101878","7.7959","0.0004","7.7959","0.0004","5.3033","0.0003","90","","90","","120","","279.13","0.03","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","Zinc perchlorate hexahydrate","","- Cl2 H12 O14 Zn -","- Cl2 H12 O14 Zn -","- Cl2 H12 O14 Zn -","1","0.0833333","LI0238","Soma Ghosh; Monika Mukherjee; Alpana Seal; Siddhartha Ray","X-ray Study of <i>M</i>^II^(ClO~4~)~2~.6H~2~O (<i>M</i>^II^ = Zn, Ni): Twinning, Disorder and Phase Transitions","Acta Crystallographica Section B","1997","53","4","639","644","10.1107/S010876819700195X","","","0.71073","MoKα","","0.0383","0.038","","0.1071","0.1065","","","","1.211","1.212","1.212","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2104359","5.775","0.003","5.775","0.003","13.238","0.004","90","","90","","120","","382.3","0.3","293","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","Bariumvanadate","","","- Ba O11 V6 -","- Ba O11 V6 -","- Ba2 O22 V12 -","2","0.166667","EB5003","Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej","Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~","Acta Crystallographica Section B","2009","65","3","326","333","10.1107/S010876810901444X","","","0.71073","MoKα","","0.0891","0.0284","","","0.0193","0.0253","","","","","","0.75","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2104360","5.763","0.003","5.763","0.003","13.206","0.004","90","","90","","120","","379.8","0.3","293","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","Bariumvandate","","","- Ba O11 V6 -","- Ba O11 V6 -","- Ba2 O22 V12 -","2","0.166667","EB5003","Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej","Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~","Acta Crystallographica Section B","2009","65","3","326","333","10.1107/S010876810901444X","","","0.71073","MoKα","","0.0757","0.0274","","","0.0214","0.0266","","","","","","0.77","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2104361","5.754","0.003","5.754","0.003","13.182","0.004","90","","90","","120","","378","0.3","293","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","Bariumvanadate","","","- Ba O11 V6 -","- Ba O11 V6 -","- Ba2 O22 V12 -","2","0.166667","EB5003","Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej","Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~","Acta Crystallographica Section B","2009","65","3","326","333","10.1107/S010876810901444X","","","0.71073","MoKα","","0.0637","0.0318","","","0.025","0.0276","","","","","","0.95","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2104362","5.746","0.003","5.746","0.003","13.16","0.004","90","","90","","120","","376.3","0.3","293","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","Bariumvanadate","","","- Ba O11 V6 -","- Ba O11 V6 -","- Ba2 O22 V12 -","2","0.166667","EB5003","Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej","Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~","Acta Crystallographica Section B","2009","65","3","326","333","10.1107/S010876810901444X","","","0.71073","MoKα","","0.071","0.0308","","","0.025","0.0279","","","","","","0.92","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2104363","5.739","0.004","5.739","0.004","13.144","0.004","90","","90","","120","","374.9","0.4","293","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","Bariumvanadate","","","- Ba O11 V6 -","- Ba O11 V6 -","- Ba2 O22 V12 -","2","0.166667","EB5003","Friese, Karen; Kanke, Yasushi; Grzechnik, Andrzej","Characterization of the pressure-induced second-order phase transition in the mixed-valence vanadate BaV~6~O~11~","Acta Crystallographica Section B","2009","65","3","326","333","10.1107/S010876810901444X","","","0.71069","MoKα","","0.0842","0.0267","","","0.0203","0.027","","","","","","0.69","","","","has coordinates","176432","2020-10-21","18:00:00",""
"2105342","4.5979","","4.5979","","15.029","","90","","90","","120","","275.156","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ag I -","- Ag I -","- Ag4 I4 -","4","0.333333","","Schock, R.N.; Johnson, Q.","The 4h polytype of silver iodide","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1482","1483","10.1107/S056774087500547X","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2105556","5.77322","0.00001","5.77322","0.00001","9.91231","0.00004","90","","90","","120","","286.116","0.0014","18","","18","","","","","","","","","3","P 63 m c","P 6c -2c","186","","zinc molybdate","","- Mo3 O8 Zn2 -","- Mo0.5 O1.33333 Zn0.333333 -","- Mo6 O16 Zn4 -","12","1","BR0083","Hibble, Simon J.; Cooper, Steven P.; Patat, Saban; Hannon, Alex. C.","Total neutron diffraction: a route to the correct local structure of disordered LaMo~2~O~5~ and its application to the model compound Zn~2~Mo~3~O~8~","Acta Crystallographica Section B","1999","55","5","683","697","10.1107/S0108768199004103","","neutron","","neutron","","0.058","","","0.047","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2106314","9.97","","9.97","","7.49","","90","","90","","120","","644.767","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ba4 O Cl6","","- Ba4 Cl6 O -","- Ba4 Cl6 O -","- Ba8 Cl12 O2 -","2","0.166667","","Frit, B.; Holmberg, B.; Galy, J.","Structure cristalline de l'oxychlorure de barium, Ba4 O Cl6","Acta Crystallographica B (24,1968-38,1982)","1970","26","","16","19","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106401","4.4389","","4.4389","","7.1635","","90","","90","","120","","122.238","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(N H4) F","","- F H4 N -","- F H4 N -","- F2 H8 N2 -","2","0.166667","","Morosin, B.","The wurtzite z parameter and linear compressibilities for N H4 F","Acta Crystallographica B (24,1968-38,1982)","1970","26","","1635","1637","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106698","3.755","","3.755","","31.99","","90","","90","","120","","390.629","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ga Se -","- Ga Se -","- Ga8 Se8 -","8","0.666667","","Kuhn, A.; Chevalier, R.; Rimsky, A.","Atomic structure of a 4H Ga Se polytype named delta-type","Acta Crystallographica B (24,1968-38,1982)","1975","31","","2841","2842","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2106726","7.719","","7.719","","5.455","","90","","90","","120","","281.48","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Li Cl O4 (H2 O)3","","- Cl H6 Li O7 -","- Cl H6 Li O7 -","- Cl2 H12 Li2 O14 -","2","0.166667","","Sequeira, A.; Bernal, I.; Faggiani, R.; Brown, I.D.","The structure of lithium perchlorate trihydrate Li (H2 O)3 Cl O4 - an X-ray and neutron diffraction study","Acta Crystallographica B (24,1968-38,1982)","1975","31","","1735","1739","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2106915","4.24","","4.24","","54.67999","","90","","90","","120","","851.316","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cd I2 -","- Cd I2 -","- Cd8 I16 -","8","0.666667","","Jain, P.C.; Trigunayat, G.C.","Refinements in the method for structure determination of polytypes: crystal structure analysis of 11 new cadmium iodide polytypes","Acta Crystallographica B (24,1968-38,1982)","1978","34","","2677","2684","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2107039","7.588","","7.588","","6.506","","90","","90","","120","","324.414","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Cs (Cr Br3)","","- Br3 Cr Cs -","- Br3 Cr Cs -","- Br6 Cr2 Cs2 -","2","0.166667","","Li, T.I.; Stucky, G.D.","The effect of exchange coupling on the spectra of transition metal ions. The crystal structure and optical spectrum of Cs Cr Br3","Acta Crystallographica B (24,1968-38,1982)","1973","29","","1529","1532","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107059","3.2417","","3.2417","","5.1876","","90","","90","","120","","47.211","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Zn O","","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Albertsson, J.; Abrahams, S.C.; Kvick, A.","Atomic displacement, anharmonic thermal vibration, expansivity and pyroelectric coefficient thermal dependences in Zn O.","Acta Crystallographica B (39,1983-)","1989","45","","34","40","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107060","8.067","","8.067","","13.203","","90","","90","","120","","744.093","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","K Yb3 F10","","- F10 K Yb3 -","- F10 K Yb3 -","- F40 K4 Yb12 -","4","0.333333","","Aleonard, S.; le Fur, Y.; Guitel, J.C.; Roux, M.T.","Structure cristalline de la phase beta - K Yb3 F10","Acta Crystallographica B (24,1968-38,1982)","1976","32","","3227","3235","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107259","4.436","","4.436","","7.158","","90","","90","","120","","121.985","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","(N D4) F","","- D4 F N -","- D4 F N -","- D8 F2 N2 -","2","0.166667","","Lawson, A.C.jr.; Roof, R.B.jr.; Jorgensen, J.D.; Schirber, J.E.; Morosin, B.","Structure of N D4 F - II","Acta Crystallographica B (39,1983-)","1989","45","","212","218","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107297","8.1976","0.0012","8.1976","0.0012","13.384","0.003","90","","90","","120","","778.9","0.2","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- F10 Rb Y3 -","- F10 Rb Y3 -","- F40 Rb4 Y12 -","4","0.333333","","McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W.","Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides","Acta Crystallographica Section B","2015","71","6","768","776","10.1107/S2052520615017916","","","0.71073","MoKα","","0.0324","0.0303","","","0.0845","0.0857","","","","","","1.16","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2107299","8.354","0.0012","8.354","0.0012","13.649","0.003","90","","90","","120","","824.9","0.2","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- F10 Gd3 Rb -","- F10 Gd3 Rb -","- F40 Gd12 Rb4 -","4","0.333333","","McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W.","Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides","Acta Crystallographica Section B","2015","71","6","768","776","10.1107/S2052520615017916","","","0.71073","MoKα","","0.0348","0.0346","","","0.0833","0.0834","","","","","","1.184","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2107300","8.042","0.0011","8.042","0.0011","13.154","0.003","90","","90","","120","","736.7","0.2","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- F10 K Lu3 -","- F10 K Lu3 -","- F40 K4 Lu12 -","4","0.333333","","McMillen, Colin D.; Comer, Sara; Fulle, Kyle; Sanjeewa, Liurukara D.; Kolis, Joseph W.","Crystal chemistry of hydrothermally grown ternary alkali rare earth fluorides","Acta Crystallographica Section B","2015","71","6","768","776","10.1107/S2052520615017916","","","0.71073","MoKα","","0.0288","0.0285","","","0.0758","0.0759","","","","","","1.187","","","","has coordinates,has Fobs","211332","2020-10-21","18:00:00",""
"2200255","10.838","0.004","10.838","0.004","8.41","0.003","90","","90","","120","","855.5","0.5","150","2","150","2","","","","","","","","3","P 63 m c","P 6c -2c","186","barium oxide iodide","","","- Ba4 I6 O -","- Ba4 I6 O -","- Ba8 I12 O2 -","2","0.166667","BR6008","Marten G. Barker; Francesconi, M. Grazia; Claire Wilson","Barium oxide iodide","Acta Crystallographica Section E","2001","57","6","i41","i43","10.1107/S1600536801006614","","","0.71069","MoKα","","0.0245","0.0223","","","","0.0506","","","","","","1.086","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2200256","10.747","0.001","10.747","0.001","7.8678","0.0009","90","","90","","120","","787","0.3","150","2","150","2","","","","","","","","3","P 63 m c","P 6c -2c","186","strontium oxide iodide","","","- I6 O Sr4 -","- I6 O Sr4 -","- I12 O2 Sr8 -","2","0.166667","","Barker, Marten G.; Francesconi, M. Grazia; Shutt, Thomas H.; Wilson, Claire","Strontium oxide iodide","Acta Crystallographica, Section E: Structure Reports Online","2001","57","6","i44","i45","10.1107/s1600536801006626","","","","","","","","","","","","","","","","","","","","","has coordinates","210325","2020-10-21","18:00:00",""
"2200735","3.982","0.002","3.982","0.002","6.445","0.003","90","","90","","120","","88.49","0.08","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Fe0.05 Mn0.95 S -","- Fe0.05 Mn0.95 S -","- Fe0.1 Mn1.9 S2 -","2","0.166667","","Eriksson, Lars; Kalinowski, Mariusz P.","Mn~1-x~ Fe~x~ S, x ≃0.05, an example of the anti-wurtzite structure","Acta Crystallographica, Section E","2001","57","","i92","i93","10.1107/S1600536801016051","","","","","","","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2200772","5.8955","0.001","5.8955","0.001","9.599","0.001","90","","90","","120","","288.93","0.08","290","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- F6 H8 N2 Si -","- F6 H8 N2 Si -","- F12 H16 N4 Si2 -","2","0.166667","WN6052","Fábry, Jan; Chval, Jindřich; Petříček, Vaclav","A new modification of diammonium hexafluorosilicate, (NH~4~)~2~SiF~6~","Acta Crystallographica Section E","2001","57","10","i90","i91","10.1107/S160053680101501X","","","0.71069","MoKα","","0.0192","0.0178","","","","0.0221","","","","","","1.7","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2203627","8.6555","0.0011","8.6555","0.0011","7.8351","0.0009","90","","90","","120","","508.35","0.11","173","2","173","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C6 H16 I N -","- C6 H16 I N -","- C12 H32 I2 N2 -","2","0.166667","LH6204","Lerner, Hans-Wolfram; Schödel, Frauke; Echensberger, David; Bolte, Michael","Rerefinement of triethylammonium iodide from new intensity data at low temperature","Acta Crystallographica Section E","2004","60","5","o863","o864","10.1107/S1600536804009183","","","0.71073","MoKα","","0.0298","0.0253","","","0.069","0.0712","","","","","","1.087","","","","has coordinates,has disorder,has Fobs","176774","2020-10-21","18:00:00",""
"2207378","10.4415","0.0008","10.4415","0.0008","8.0464","0.0007","90","","90","","120","","759.73","0.11","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","tetrasamarium(II) oxide hexaiodide","tetrasamarium hexaiodine oxygen","","- I6 O Sm4 -","- I6 O Sm4 -","- I12 O2 Sm8 -","2","0.166667","WM6099","Hammerich, Stefanie; Pantenburg, Ingo; Meyer, Gerd","Tetrasamarium(II) oxide hexaiodide, Sm~4~OI~6~","Acta Crystallographica Section E","2005","61","11","i234","i236","10.1107/S1600536805031934","","","0.71073","MoKα","","0.0447","0.0422","","","0.0977","0.1042","","","","","","1.094","","","","has coordinates,has Fobs","176774","2020-10-21","18:00:00",""
"2214030","9.364","0.0011","9.364","0.0011","13.3018","0.0019","90","","90","","120","","1010.1","0.2","173","2","173","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","η^5^-Cyclopentadienyl-η^6^-mesitylenyl-iron(III) hexafluoridophosphate chloroform solvate","","- C15 H18 Cl3 F6 Fe P -","- C15.04 H18.04 Cl3 F6 Fe P -","- C30.08 H36.08 Cl6 F12 Fe2 P2 -","2","0.166667","AT2319","Sánchez Perucha, Alejandro; Bolte, Michael","(η^5^-Cyclopentadienyl)(η^6^-mesitylenyl)iron(II) hexafluorophosphate chloroform solvate","Acta Crystallographica Section E","2007","63","7","m1897","m1897","10.1107/S1600536807026827","","","0.71073","MoKα","","0.0363","0.0357","","","0.0987","0.0996","","","","","","1.125","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2214342","6.7921","0.0001","6.7921","0.0001","10.9922","0.0002","90","","90","","120","","439.161","0.012","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","nickel phosphide (5/4)","pentanickel tetraphosphide","","- Ni5 P4 -","- Ni5 P4 -","- Ni20 P16 -","4","0.333333","MG2021","Zelinska, Mariya; Oryshchyn, Stepan; Zhak, Olga; Pivan, Jean-Yves; Potel, Michel; Noël, Henri","Redetermination of Ni~5~P~4~","Acta Crystallographica Section E","2007","63","7","i158","i159","10.1107/S1600536807028164","","","0.71069","MoKα","","0.0447","0.0271","","","0.032","0.0341","","","","","","1.059","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2218561","10.53","0.003","10.53","0.003","6.398","0.002","90","","90","","120","","614.4","0.3","293","2","293","1","","","","","","","","4","P 63 m c","P 6c -2c","186","Calcium Lanthaum Borate","tricalcium trilanthanum pentakis(orthoborate)","","- B5 Ca3 La3 O15 -","- B5 Ca3 La3 O15 -","- B10 Ca6 La6 O30 -","2","0.166667","WM2179","Zhou, Tianyong; Ye, Ning","Redetermination of tricalcium trilanthanum pentakis(orthoborate) from single-crystal data","Acta Crystallographica Section E","2008","64","6","i37","","10.1107/S1600536808014785","","","0.71073","MoKα","","","0.0119","","","","0.0303","","","","","","0.889","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2218903","6.8827","0.0008","6.8827","0.0008","11.9188","0.0016","90","","90","","120","","488.97","0.1","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","Cs-struvite (hexagonal)","Caesium hexaaquamagnesium orthophosphate","","- Cs H12 Mg O10 P -","- Cs H12 Mg O10 P -","- Cs2 H24 Mg2 O20 P2 -","2","0.166667","BR2080","Weil, Matthias","Redetermination of the hexagonal struvite analogue Cs[Mg(OH~2~)~6~](PO~4~)","Acta Crystallographica Section E","2008","64","8","i50","","10.1107/S1600536808023283","","","0.71073","MoKα","","0.0163","0.0157","","","0.0331","0.0337","","","","","","1.29","","","","has coordinates,has Fobs","176787","2020-10-21","18:00:00",""
"2222487","5.7816","0.0002","5.7816","0.0002","9.9345","0.0003","90","","90","","120","","287.589","0.017","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","dizinc trimolybdenum(IV) octaoxide","","- Mo3 O8 Zn2 -","- Mo3 O8 Zn2 -","- Mo6 O16 Zn4 -","2","0.166667","WM2235","Cuny, Jerome; Gougeon, Patrick; Gall, Philippe","Redetermination of Zn~2~Mo~3~O~8~","Acta Crystallographica Section E","2009","65","7","i51","","10.1107/S1600536809021928","","","0.71069","MoKα","","0.0137","0.0133","","","0.0293","0.0293","","","","","","1.158","","","","has coordinates,has Fobs","176789","2020-10-21","18:00:00",""
"2237694","5.4705","0.0001","5.4705","0.0001","13.0895","0.0004","90","","90","","120","","339.241","0.014","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","Ammonium diphosphitoindate(III)","","- H6 In N O6 P2 -","- H6 In N O6 P2 -","- H12 In2 N2 O12 P4 -","2","0.166667","RU2050","Hamchaoui, Farida; Rebbah, Houria; Le Fur, Eric","Ammonium diphosphitoindate(III)","Acta Crystallographica Section E","2013","69","4","i21","i22","10.1107/S160053681300771X","","","0.71073","MoKα","","0.0194","0.0172","","","0.0403","0.0408","","","","","","1.262","","","","has coordinates","176798","2020-10-21","18:00:00",""
"2238069","12.7651","0.0003","12.7651","0.0003","5.0844","0.0001","90","","90","","120","","717.49","0.03","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","Magnesium hydroxide hydrogenarsenate (6.75/3/4)","","- As4 H4.5 Mg6.75 O19 -","- As4 Mg6.75 O19 -","- As8 Mg13.5 O38 -","2","0.166667","VN2069","Weil, Matthias","Mg~6.75~(OH)~3~(H~0.166~AsO~4~)~3~(HAsO~4~), a member of the <i>M</i>~1-~<i>~x~M</i>'~6~(OH)~3~(H~2<i>x~/3</i>AsO~4~)~3~(HAsO~4~) family (<i>M</i>,<i>M</i>' = Co; Ni)","Acta Crystallographica Section E","2013","69","5","i29","","10.1107/S1600536813010714","","","0.71073","MoKα","","0.0329","0.0291","","","0.0568","0.0575","","","","","","1.205","","","","has coordinates,has Fobs","176435","2020-10-21","18:00:00",""
"2241733","5.7268","0.0003","5.7268","0.0003","9.9841","0.0006","90","","90","","120","","283.57","0.03","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","Dilithium germanium trimolybdenum octaoxide","","- Ge Li2 Mo3 O8 -","- Ge Li2 Mo3 O8 -","- Ge2 Li4 Mo6 O16 -","2","0.166667","WM5299","Gall, Philippe; Gougeon, Patrick","Li~2~GeMo~3~O~8~: a novel reduced molybdenum oxide containing Mo~3~O~13~ cluster units","Acta Crystallographica Section E","2016","72","7","995","997","10.1107/S2056989016009750","","","0.71073","MoKα","","0.0322","0.0304","","","0.0753","0.0762","","","","","","1.101","","","","has coordinates,has Fobs","183845","2020-10-21","18:00:00",""
"2243616","6.0378","0.0005","6.0378","0.0005","9.8133","0.0009","90","","90","","120","","309.82","0.05","301","2","301","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","Barium cerium lutetium aluminosilicate nitride oxide","","- Al0.4 Ba1.8 Ce0.2 Lu2 N13.8 O0.2 Si7.6 -","- Al0.4 Ba1.8 Ce0.2 Lu2 N13.7998 O0.2002 Si7.6 -","- Al0.4 Ba1.8 Ce0.2 Lu2 N13.7998 O0.2002 Si7.6 -","1","0.0833333","RU2072","Simura, Rayko; Yamane, Hisanori","Lu-atom-ordered oxonitridoaluminosilicate Ba~0.9~Ce~0.1~LuAl~0.2~Si~3.8~N~6.9~O~0.1~","Acta Crystallographica Section E","2020","76","11","1708","1711","10.1107/S2056989020013158","","","0.71073","MoKα","","0.0228","0.022","","","0.0539","0.0548","","","","","","1.037","","","","has coordinates,has Fobs","258224","2020-10-21","18:00:00",""
"2300112","3.2494","0.0002","3.2494","0.0002","5.2054","0.0002","90","","90","","120","","47.598","0.005","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","zinc_oxide","","","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","KO5022","Sowa, Heidrun; Ahsbahs, Hans","High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape","Journal of Applied Crystallography","2006","39","2","169","175","10.1107/S0021889805042457","","","0.71073","MoKα","","0.0149","0.0149","","0.0369","0.0369","","","","1.446","1.446","1.446","","","","","has coordinates","201980","2020-10-21","18:00:00",""
"2300113","3.2342","0.0002","3.2342","0.0002","5.1772","0.0003","90","","90","","120","","46.899","0.005","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","zinc_oxide","","","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","KO5022","Sowa, Heidrun; Ahsbahs, Hans","High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape","Journal of Applied Crystallography","2006","39","2","169","175","10.1107/S0021889805042457","","","0.71073","MoKα","","0.0163","0.0163","","0.0404","0.0404","","","","1.364","1.364","1.364","","","","","has coordinates","201980","2020-10-21","18:00:00",""
"2300114","3.219","0.0003","3.219","0.0003","5.1489","0.0003","90","","90","","120","","46.205","0.007","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","zinc_oxide","","","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","KO5022","Sowa, Heidrun; Ahsbahs, Hans","High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape","Journal of Applied Crystallography","2006","39","2","169","175","10.1107/S0021889805042457","","","0.71073","MoKα","","0.0179","0.0179","","0.0436","0.0436","","","","1.382","1.382","1.382","","","","","has coordinates","201980","2020-10-21","18:00:00",""
"2300115","3.2049","0.0003","3.2049","0.0003","5.1216","0.0004","90","","90","","120","","45.558","0.007","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","zinc_oxide","","","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","KO5022","Sowa, Heidrun; Ahsbahs, Hans","High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape","Journal of Applied Crystallography","2006","39","2","169","175","10.1107/S0021889805042457","","","0.71073","MoKα","","0.0221","0.0221","","0.0512","0.0512","","","","1.289","1.289","1.289","","","","","has coordinates","201980","2020-10-21","18:00:00",""
"2300116","3.195","0.0003","3.195","0.0003","5.1027","0.0004","90","","90","","120","","45.11","0.007","293","2","293","2","","","","","","","","2","P 63 m c","P 6c -2c","186","zinc_oxide","","","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","KO5022","Sowa, Heidrun; Ahsbahs, Hans","High-pressure X-ray investigation of zincite ZnO single crystals using diamond anvils with an improved shape","Journal of Applied Crystallography","2006","39","2","169","175","10.1107/S0021889805042457","","","0.71073","MoKα","","0.014","0.014","","0.0325","0.0325","","","","1.194","1.194","1.194","","","","","has coordinates","201980","2020-10-21","18:00:00",""
"2300450","3.249308","0.000018","3.249308","0.000018","5.205709","0.000038","90","","90","","120","","47.5984","0.0005","298","","298","","","","","","","","","2","P 63 m c","P 6c -2c","186","","zinc oxide","zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","TO5064","Schreyer, Martin; Guo, Liangfeng; Thirunahari, Satyanarayana; Gao, Feng; Garland, Marc","Simultaneous determination of several crystal structures from powder mixtures: the combination of powder X-ray diffraction, band-target entropy minimization and Rietveld methods","Journal of Applied Crystallography","2014","47","2","659","667","10.1107/S1600576714003379","powder diffraction","","1.5418","CuKα","","","","","","","","","0.018","0.44","","","","","","","has coordinates,has Fobs","199986","2020-10-21","18:00:00",""
"2310195","9.86","","9.86","","6.23","","90","","90","","120","","524.533","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ni3 Th7 -","- Ni3 Th7 -","- Ni6 Th14 -","2","0.166667","","Florio, J.V.; Baenziger, N.C.; Rundle, R.E.","Compounds of thorium with transition metals. 2. Systems with iron, cobalt and nickel","Acta Crystallographica (1,1948-23,1967)","1956","9","","367","372","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310262","5.186","","5.186","","8.566","","90","","90","","120","","199.514","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Lu Mn5 -","- Lu Mn5 -","- Lu2 Mn10 -","2","0.166667","","Wang, F.E.; Gilfrich, J.V.","The crystal structures of Lu Mn5 and the R Mn12 compounds (where R= Gd, Tb, Dy, Ho, Er and Tm)","Acta Crystallographica (1,1948-23,1967)","1966","21","","476","481","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310263","14.352","","14.352","","14.218","","90","","90","","120","","2536.26","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Gd13 Zn58 -","- Gd13 Zn58 -","- Gd26 Zn116 -","2","0.166667","","Wang, F.E.","The crystal structure of Gd13 Zn58","Acta Crystallographica (1,1948-23,1967)","1967","22","","579","584","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310302","9.587","","9.587","","21.825","","90","","90","","120","","1737.2","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ce24 Co11 -","- Ce24 Co11 -","- Ce48 Co22 -","2","0.166667","","Larson, A.C.; Cromer, D.T.","The crystal structure of Ce24 Co11","Acta Crystallographica (1,1948-23,1967)","1962","15","","1224","1227","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310310","9.92","","9.92","","6.33","","90","","90","","120","","539.458","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ce7 Ni3 -","- Ce7 Ni3 -","- Ce14 Ni6 -","2","0.166667","","Roof, R.B.jr.; Larson, A.C.; Cromer, D.T.","The crystal structure of Ce7 Ni3","Acta Crystallographica (1,1948-23,1967)","1961","14","","1084","1087","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310332","5.759","","5.759","","9.903","","90","","90","","120","","284.441","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Zn2 Mo3 O8","","- Mo3 O8 Zn2 -","- Mo3 O8 Zn2 -","- Mo6 O16 Zn4 -","2","0.166667","","Ansell, G.B.; Katz, L.","A refinement of the crystal structure of zinc molybdenum(IV) oxide, Zn2 Mo3 O8","Acta Crystallographica (1,1948-23,1967)","1966","21","","482","485","","","","","","","","","","","","","","","","","","","","","","has coordinates","148394","2020-10-21","18:00:00",""
"2310415","3.281","","3.281","","21.67","","90","","90","","120","","202.024","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Al5 C3 N","","- C3 Al5 N -","- C3 Al5 N -","- C6 Al10 N2 -","2","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","176429","2020-10-21","18:00:00",""
"2310416","3.226","","3.226","","31.7","","90","","90","","120","","285.706","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Al7 C3 N3","","- C3 Al7 N3 -","- C3 Al7 N3 -","- C6 Al14 N6 -","2","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","149234","2020-10-21","18:00:00",""
"2310546","6.758","","6.758","","5.778","","90","","90","","120","","228.531","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ba Ti S3","","- Ba S3 Ti -","- Ba S3 Ti -","- Ba2 S6 Ti2 -","2","0.166667","","Clearfield, A.","The synthesis and crystal structures of some alkaline earth titanium and zirkonium sulfides","Acta Crystallographica (1,1948-23,1967)","1963","16","","135","142","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2310592","5.854","","5.854","","9.295","","90","","90","","120","","275.858","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Fe2.5 V7.11 O16","","- Fe2.5 O16 V7.11 -","- Fe2.5 O16 V7.11 -","- Fe2.5 O16 V7.11 -","1","0.0833333","","Hanson, A.W.","The crystal structure of nolanite","Acta Crystallographica (1,1948-23,1967)","1958","11","","703","709","","","","","","","","","","","","","","","","","","","","","","has coordinates","150967","2020-10-21","18:00:00",""
"2310812","3.82","","3.82","","50.07999","","90","","90","","120","","632.88","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Zn S","","- S Zn -","- S Zn -","- S16 Zn16 -","16","1.33333","","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",""
"2310902","10.028","","10.028","","6.293","","90","","90","","120","","548.046","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Rh3 Th7 -","- Rh3 Th7 -","- Rh6 Th14 -","2","0.166667","","Ferro, R.; Rambaldi, G.","The phase D102 type in the thorium-rhodium alloy system","Acta Crystallographica (1,1948-23,1967)","1961","14","","1094","1094","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"2310932","3.079","","3.079","","20.146","","90","","90","","120","","165.401","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Si C","","- C Si -","- C Si -","- C8 Si8 -","8","0.666667","","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",""
"2311946","12.4912","0.0005","12.4912","0.0005","7.4526","0.0003","90","","90","","120","","1007.04","0.07","296","","296","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Heptapotassium silver tetrakis(tetraoxotungstate)","","- Ag K7 O16 W4 -","- Ag K7 O16 W4 -","- Ag2 K14 O32 W8 -","2","0.166667","LY3055","Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu; Lazoryak, Bogdan I.; Korolkov, Iliya V.; Khaikina, Elena G.","Synthesis, crystal structures and properties of the new compounds K<sub>7-x</sub>Ag<sub>1+x</sub>(XO<sub>4</sub>)<sub>4</sub> (X = Mo, W).","Acta crystallographica. Section C, Structural chemistry","2017","73","Pt 12","1071","1077","10.1107/S2053229617015674","powder diffraction","","1.5418","CuKα","","","","","","","","","","3.64","","","","","","","has coordinates","246182","2020-10-21","18:00:00",""
"2311947","12.4188","0.0002","12.4188","0.0002","7.4338","0.0002","90","","90","","120","","992.89","0.03","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","Heptapotassium silver tetrakis(tetraoxomolybdate)","","- Ag1.32 K6.68 Mo4 O16 -","- Ag1.318 K6.682 Mo4 O16 -","- Ag2.636 K13.364 Mo8 O32 -","2","0.166667","LY3055","Spiridonova, Tatyana S.; Solodovnikov, Sergey F.; Savina, Aleksandra A.; Solodovnikova, Zoya A.; Stefanovich, Sergey Yu; Lazoryak, Bogdan I.; Korolkov, Iliya V.; Khaikina, Elena G.","Synthesis, crystal structures and properties of the new compounds K<sub>7-x</sub>Ag<sub>1+x</sub>(XO<sub>4</sub>)<sub>4</sub> (X = Mo, W).","Acta crystallographica. Section C, Structural chemistry","2017","73","Pt 12","1071","1077","10.1107/S2053229617015674","","","0.71073","MoKα","","0.0181","0.0179","","","0.0402","0.0403","","","","","","1.12","","","","has coordinates","246182","2020-10-21","18:00:00",""
"2312498","5.876","0.003","5.876","0.003","9.418","0.005","90","","90","","120","","281.6","0.3","293","","293","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ge4 N4 O4 Sn -","- Ge4 N4 O4 Sn -","- Ge8 N8 O8 Sn2 -","2","0.166667","","Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute","Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction.","Acta crystallographica Section B, Structural science, crystal engineering and materials","2024","80","3","","","10.1107/S2052520624002683","","electron","0.0197","electron","","0.1001","0.0942","","","0.1053","0.1064","","","","3.5927","3.5927","3.3713","","","","has coordinates","291814","2024-05-11","01:46:12",""
"2312499","5.839","0.001","5.839","0.001","9.365","0.002","90","","90","","120","","276.51","0.09","","","293","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ge4.158 N4 O4 Sn0.842 -","- Ge4.16 N4 O4 Sn0.84 -","- Ge8.32 N8 O8 Sn1.68 -","2","0.166667","","Gollé-Leidreiter, Philipp; Bhat, Shrikant; Wiehl, Leonore; Wen, Qingbo; Kroll, Peter; Ishikawa, Ryo; Etter, Martin; Farla, Robert; Ikuhara, Yuichi; Riedel, Ralf; Kolb, Ute","Crystal structures of two new high-pressure oxynitrides with composition SnGe<sub>4</sub>N<sub>4</sub>O<sub>4</sub>, from single-crystal electron diffraction.","Acta crystallographica Section B, Structural science, crystal engineering and materials","2024","80","3","","","10.1107/S2052520624002683","","electron","0.0197","electron","","0.1158","0.1125","","","0.1333","0.1337","","","","4.9125","4.9125","4.8307","","","","has coordinates","291814","2024-05-11","01:46:12",""
"3000229","5.6244","0.0003","5.6244","0.0003","8.8417","0.0003","90","0.004","90","0.004","120","0.006","242.22","0.02","100","","100","","","","","","","","","3","P 63 m c","P 6c -2c","","","","","- Al5 H O8 -","","","","","","Parise, John B.; Xia, Bingying; Simonson, Jack W.; Woerner, William R.; Plonka, Anna M.; Phillips, Brian L.; Ehm, Lars","","To be published in Crystals","","","","","","","","x-ray","0.41328","synchrotron","","0.0275","0.0255","","","0.0618","0.0621","","","","2.39","2.39","2.33","","","","","214707","2020-10-21","18:00:00","2020-03-19"
"3000230","5.576099","0.000017","5.5761","","8.77247","0.00006","90","","90","","120","","236.218","0.0018","","","","","","","","","","","","3","P 63 m c","P 6c -2c","","","","","- Al5 H O8 -","","","","","","Parise, John B.; Xia, Bingying; Simonson, Jack W.; Woerner, William R.; Plonka, Anna M.; Phillips, Brian L.; Ehm, Lars","","To be published in Crystals","","","","","","","","","","","","","","","","","","","","","","","","","","","","214708","2020-10-21","18:00:00","2020-03-19"
"3500056","12.4544","0.0004","12.4544","0.0004","4.94856","0.00018","90","","90","","120","","664.75","0.04","295","","295","","","","","","","","Hydrothermal synthesis","4","P 63 m c","P 6c -2c","186","","","","- H12 Ni12 O38 P8 -","- Ni12 O38 P8 -","- Ni12 O38 P8 -","1","0.0833333","","Armel Le Bail","Ni12(HPO4)6(PO4)2(OH)6 P63mc related to COD 4313804 and to COD 1000115 and dumortierite","Personal communication to COD","2016","","","","","","powder diffraction","x-ray","1.54184","CuKα","","","","","","","","","3.0816","","","","","","","","has coordinates","189008","2020-10-21","18:00:00",""
"4000325","3.2026","0.0005","3.2026","0.0005","5.1987","0.001","90","","90","","120","","46.178","0.014","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","Gallium manganese nitride (0.9813/0.0187/1)","","- Ga0.98 Mn0.02 N -","- Ga0.98 Mn0.02 N -","- Ga1.96 Mn0.04 N2 -","2","0.166667","","","","Chemistry of Materials","2003","","","","","","","","0.71073","MoKα","","0.0146","0.0118","","","0.0227","0.0237","","","","","","1.275","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000326","3.1968","0.0005","3.1968","0.0005","5.1901","0.001","90","","90","","120","","45.934","0.013","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","Gallium manganese nitride (0.9525/0.0475/1)","","- Ga0.95 Mn0.05 N -","- Ga0.95 Mn0.05 N -","- Ga1.9 Mn0.1 N2 -","2","0.166667","","","","Chemistry of Materials","2003","","","","","10.1021/cm034500d","","","0.71073","MoKα","","0.0217","0.0203","","","0.04","0.0409","","","","","","1.358","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000879","7.09109","0.00005","7.09109","","11.50958","0.0001","90","","90","","120","","501.206","0.006","300","","300","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- H4 I Li3 N2 -","- H4.0005 I Li3 N2 -","- H16.002 I4 Li12 N8 -","4","0.333333","","Matsuo, Motoaki; Sato, Toyoto; Miura, Yohei; Oguchi, Hiroyuki; Zhou, Yu; Maekawa, Hideki; Takamura, Hitoshi; Orimo, Shin-ichi","Synthesis and Lithium Fast-Ion Conductivity of a New Complex Hydride Li3(NH2)2I with Double-Layered Structure","Chemistry of Materials","2010","22","9","2702","","10.1021/cm1006857","powder diffraction","","0.800562","Synchrotron","","","","","","","","","","2.04","","","","","","","has coordinates","178377","2020-10-21","18:00:00",""
"4000911","6.986813","0.000009","6.986813","0.000009","12.037947","0.000002","90","","90","","120","","508.91","0.0009","","","300","","","","","","","","","5","P 63 m c","P 6c -2c","186","Cs-Mn-struvite (hexagonal)","struvite","","- Cs2 H12 Mn2 O20 P2 -","- Cs Mn O9.99982 P -","- Cs2 Mn2 O19.9996 P2 -","2","0.166667","","Ferdov, Stanislav; Lin, Zhi","Selective Detection of Cs+in Water Solutions via One-Step Formation of a New Type of Struvite-Like Phosphate","Chemistry of Materials","2010","22","18","5345","","10.1021/cm101657z","powder diffraction","","1.5406","CuKα","","","","","","","","","4.3604","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4001316","3.1932","0.0015","3.1932","0.0015","5.185","0.003","90","","90","","120","","45.79","0.04","100","2","100","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Ga0.96 Mn0.04 N -","- Ga0.96 Mn0.04 N -","- Ga1.92 Mn0.08 N2 -","2","0.166667","","Kaminski, Michal; Podsiadlo, Slawomir; Dominik, Pawel; Wozniak, Krzysztof; Dobrzycki, Lukasz; Jakiela, Rafal; Barcz, Adam; Psoda, Marek; Mizera, Jaroslaw; Bacewicz, Rajmund; Zajac, Marcin; Twardowski, Andrzej","New Chemical Method of Obtaining Thick Ga1-xMnxN Layers: Prospective Spintronic Material","Chemistry of Materials","2007","19","13","3139","","10.1021/cm062459j","","","0.71073","MoKα","","0.0111","0.0084","","","0.0198","0.0201","","","","","","1.32","","","","has coordinates,has disorder","178377","2020-10-21","18:00:00",""
"4001352","15.269","0.002","15.269","0.002","10.336","0.003","90","","90","","120","","2086.9","0.7","293","2","293","2","","","","","","","","8","P 63 m c","P 6c -2c","186","","","","- C12 H40 Al0.57 Cr0.1 N2 O16 P4 Zn2 -","- C12 Al0.57 Cr0.0966667 N2 O16.02 P4 Zn2 -","- C36 Al1.71 Cr0.29 N6 O48.06 P12 Zn6 -","3","0.25","","Yang, Yali; Li, Niu; Song, Haibin; Wang, Honggen; Chen, Wenbin; Xiang, Shouhe","Metal Phosphite Containing 24-Ring Channels with 10-Ring Windows","Chemistry of Materials","2007","19","8","1889","","10.1021/cm070026q","","","0.71073","MoKα","","0.0565","0.0486","","","0.1405","0.1518","","","","","","1.143","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4001595","5.810528","0.000007","5.810528","","23.88459","0.00005","90","","90","","120","","698.36","0.0017","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ba5 Mg0.125 O15 Ta3.95 -","- Ba4.99999 Mg0.125 O15 Ta3.95 -","- Ba9.99998 Mg0.25 O30 Ta7.9 -","2","0.166667","","Mallinson, P.; Claridge, J. B.; Iddles, D.; Price, T.; Ibberson, R. M.; Allix, M.; Rosseinsky, M. J.","New 10-Layer Hexagonal Perovskites: Relationship between Cation and Vacancy Ordering and Microwave Dielectric Loss","Chemistry of Materials","2006","18","26","6227","","10.1021/cm0616477","powder diffraction","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4002361","11.8816","","11.8816","","7.0714","","90","","90","","120","","864.542","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba6 La2 Fe4 O15","","- Ba6 Fe4 La2 O15 -","- Ba5.9999 Fe4 La2.0001 O15 -","- Ba11.9998 Fe8 La4.0002 O30 -","2","0.166667","","Abe, K.; Doi, Y.; Hinatsu, Y.; Ohoyama, K.","Magnetic properties of the spin tetramer compound Ba6 La2 Fe4 O15","Chemistry of Materials (1,1989-)","2006","18","","785","789","","","","","","","","","","","","","","","","","","","","","","has coordinates","150286","2020-10-21","18:00:00",""
"4002362","11.8426","","11.8426","","7.09","","90","","90","","120","","861.134","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba6 La2 Ga4 O15","","- Ba6 Ga4 La2 O15 -","- Ba5.9999 Ga4 La2.0001 O15 -","- Ba11.9998 Ga8 La4.0002 O30 -","2","0.166667","","Abe, K.; Doi, Y.; Hinatsu, Y.; Ohoyama, K.","Magnetic properties of the spin tetramer compound Ba6 La2 Fe4 O15","Chemistry of Materials (1,1989-)","2006","18","","785","789","","","","","","","","","","","","","","","","","","","","","","has coordinates","150287","2020-10-21","18:00:00",""
"4002702","10.4084","0.0003","10.4084","0.0003","7.2791","0.0002","90","","90","","120","","682.93","0.03","298","2","298","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- Cl Ge4 Na O16 Sr2 V3 -","- Cl Ge4 Na0.9999 O16 Sr2.0001 V3 -","- Cl2 Ge8 Na1.9998 O32 Sr4.0002 V6 -","2","0.166667","","Sanjeewa, Liurukara D.; McGuire, Michael A.; McMillen, Colin D.; Garlea, Vasile O.; Kolis, Joseph W.","Polar Materials with Isolated V4+ S = 1/2 Triangles: NaSr2V3O3(Ge4O13)Cl and KSr2V3O3(Ge4O13)Cl","Chemistry of Materials","2017","29","3","1404","","10.1021/acs.chemmater.6b05320","","","0.71073","MoKα","","0.0365","0.0365","","","0.1042","0.1042","","","","","","1.094","","","","has coordinates","193406","2020-10-21","18:00:00",""
"4002703","10.4679","0.0007","10.4679","0.0007","7.2427","0.0005","90","","90","","120","","687.31","0.08","298","2","298","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- Cl Ge4 K O16 Sr2 V3 -","- Cl Ge4 K0.9999 O16 Sr2.0001 V3 -","- Cl2 Ge8 K1.9998 O32 Sr4.0002 V6 -","2","0.166667","","Sanjeewa, Liurukara D.; McGuire, Michael A.; McMillen, Colin D.; Garlea, Vasile O.; Kolis, Joseph W.","Polar Materials with Isolated V4+ S = 1/2 Triangles: NaSr2V3O3(Ge4O13)Cl and KSr2V3O3(Ge4O13)Cl","Chemistry of Materials","2017","29","3","1404","","10.1021/acs.chemmater.6b05320","","","0.71073","MoKα","","0.038","0.0379","","","0.0846","0.0846","","","","","","1.057","","","","has coordinates","193406","2020-10-21","18:00:00",""
"4002704","10.8797","0.0012","10.8797","0.0012","6.9926","0.0015","90","","90","","120","","716.81","0.19","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Bi3 F3 I4 O13 -","- Bi3 F3 I4 O13 -","- Bi6 F6 I8 O26 -","2","0.166667","","Zhang, Min; Su, Xin; Mutailipu, Miriding; Yang, Zhihua; Pan, Shilie","Bi3OF3(IO3)4: Metal Oxyiodate Fluoride Featuring a Carbon-Nanotube-like Topological Structure with Large Second Harmonic Generation Response","Chemistry of Materials","2017","29","3","945","","10.1021/acs.chemmater.6b05468","","","0.71073","MoKα","","0.0304","0.029","","","0.0657","0.0664","","","","","","1.042","","","","has coordinates","193409","2020-10-21","18:00:00",""
"4003635","7.1711","0.001","7.1711","0.001","11.7115","0.0017","90","","90","","120","","521.57","0.13","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- F6 Ga3 O6 Rb Se2 -","- F6 Ga3 O6 Rb Se2 -","- F12 Ga6 O12 Rb2 Se4 -","2","0.166667","","Wu, Chao; Jiang, Xingxing; Lin, Lin; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi","AGa3F6(SeO3)2 (A = Rb, Cs): A New Type of Phase-Matchable Hexagonal Tungsten Oxide Material with Strong Second-Harmonic Generation Responses","Chemistry of Materials","2020","","","","","10.1021/acs.chemmater.0c01971","","","0.71073","MoKα","","0.0374","0.0364","","","0.0951","0.0959","","","","","","1.096","","","","has coordinates","254353","2020-10-21","18:00:00",""
"4003636","7.1876","0.0005","7.1876","0.0005","11.8681","0.0009","90","","90","","120","","530.98","0.07","273","2","273","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- Cs F6 Ga3 O6 Se2 -","- Cs F6 Ga3 O6 Se2 -","- Cs2 F12 Ga6 O12 Se4 -","2","0.166667","","Wu, Chao; Jiang, Xingxing; Lin, Lin; Lin, Zheshuai; Huang, Zhipeng; Humphrey, Mark G.; Zhang, Chi","AGa3F6(SeO3)2 (A = Rb, Cs): A New Type of Phase-Matchable Hexagonal Tungsten Oxide Material with Strong Second-Harmonic Generation Responses","Chemistry of Materials","2020","","","","","10.1021/acs.chemmater.0c01971","","","0.71073","MoKα","","0.0429","0.0406","","","0.1317","0.1337","","","","","","1.093","","","","has coordinates","254354","2020-10-21","18:00:00",""
"4003855","4.015","0.0018","4.015","0.0018","11.766","0.005","90","","90","","120","","164.26","0.13","300","","300","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- As Na Sn -","- As Na Sn -","- As2 Na2 Sn2 -","2","0.166667","","Ochs, Andrew M.; Gorai, Prashun; Wang, Yaxian; Scudder, Michael R.; Koster, Karl; Moore, Curtis E.; Stevanovic, Vladan; Heremans, Joseph P.; Windl, Wolfgang; Toberer, Eric S.; Goldberger, Joshua E.","Computationally Guided Discovery of Axis-Dependent Conduction Polarity in NaSnAs Crystals","Chemistry of Materials","2021","","","","","10.1021/acs.chemmater.0c04030","","x-ray","0.71073","MoKα","K-L~3~","0.0329","0.031","","","0.0736","0.0742","","","","","","1.635","","","","has coordinates","261003","2021-01-16","23:14:35",""
"4004057","4.654","0.0004","4.654","0.0004","7.6686","0.0015","90","","90","","120","","143.85","0.03","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.28 Mn0.86 Sb2 Yb2 -","- Ag0.26 Mn0.88 Sb2 Yb2 -","- Ag0.26 Mn0.88 Sb2 Yb2 -","1","0.0833333","","Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing","Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb)","Chemistry of Materials","2021","33","24","9732","9740","10.1021/acs.chemmater.1c03527","","","0.71073","MoKα","","0.0361","0.0327","","","0.0715","0.0738","","","","","","1.222","","","","has coordinates","271767","2022-01-03","23:16:28",""
"4004058","4.6848","0.0006","4.6848","0.0006","7.7443","0.0018","90","","90","","120","","147.2","0.04","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.58 Ca2 Mn0.71 Sb2 -","- Ag0.58 Ca2 Mn0.71 Sb2 -","- Ag0.58 Ca2 Mn0.71 Sb2 -","1","0.0833333","","Liu, Kefeng; Liu, Jian; Liu, Qian; Wang, Qiqi; Yu, Fang; Liu, Xiao-Cun; Xia, Sheng-Qing","Phase Transitions, Structure Evolution, and Thermoelectric Properties Based on A2MnSb2 (A = Ca, Yb)","Chemistry of Materials","2021","33","24","9732","9740","10.1021/acs.chemmater.1c03527","","","0.71073","MoKα","","0.035","0.0319","","","0.0746","0.0785","","","","","","1.34","","","","has coordinates","271768","2022-01-03","23:16:45",""
"4030284","9.2549","0.0003","9.2549","0.0003","6.9413","0.0003","90","","90","","120","","514.89","0.03","","","293","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ce4 Cl2 O S4 -","- Ce4 Cl1.5 O S4.5 -","- Ce8 Cl3 O2 S9 -","2","0.166667","","Schleid, T.","Ce4OS4Cl2 : the first oxysulfide-chloride of the lanthanides","European Journal of Solid State and Inorganic Chemistry","1991","28","","737","748","","","x-ray","0.71069","MoKα","","","0.021","","","0.019","","","","","","","","","","","has coordinates","178481","2020-10-21","18:00:00",""
"4030845","9.4513","0.0004","9.4513","0.0004","7.2036","0.001","90","","90","","120","","557.27","0.08","","","293","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Cl6 O Sr4 -","- Cl6 O Sr4 -","- Cl12 O2 Sr8 -","2","0.166667","","Hagemann, H.; Kubel, F.; Bill, H.","Crystal structure of Sr4OCl6","European Journal of Solid State and Inorganic Chemistry","1996","33","","1101","1109","","","x-ray","0.71073","MoKα","","","0.034","","","0.024","","","","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4030894","6.0037","0.0001","6.0037","0.0001","15.8194","0.0005","90","","90","","120","","493.809","0.019","","","298","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Li Mo2 O8 Tl3 -","- Li Mo2 O8 Tl3 -","- Li2 Mo4 O16 Tl6 -","2","0.166667","","Colbeau-Justin, C.; Wallez, G.; Xuriguera, A.-M.; Elfakir, A.; Jaulmes, S.; Quarton, M.","Structure determination of Tl3Li(MoO4)2. Stereochemical activity of Tl(I) lone pair","European Journal of Solid State and Inorganic Chemistry","1997","34","","1097","1106","","powder diffraction","neutron","1.5938","","","","","","","","","","0.0657","","","","","","","","has coordinates","178487","2020-10-21","18:00:00",""
"4107203","11.5158","0.0009","11.5158","0.0009","7.6132","0.0012","90","","90","","120","","874.35","0.17","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C3 Ba4 Cs3 F5 O9 -","- C3 Ba4 Cs3 F5 O9 -","- C6 Ba8 Cs6 F10 O18 -","2","0.166667","","Guohong Zou; Ning Ye; Ling Huang; Xinsong Lin","Alkaline-Alkaline Earth Fluoride Carbonate Crystals ABCO3F (A = K, Rb, Cs; B = Ca, Sr, Ba) as Nonlinear Optical Materials","Journal of the American Chemical Society","2011","133","","20001","20007","10.1021/ja209276a","","","0.71073","MoKα","","0.0201","0.0188","","","0.037","0.0446","","","","","","1.167","","","","has coordinates","178818","2020-10-21","18:00:00",""
"4114282","7.1701","0.0015","7.1701","0.0015","6.0403","0.0012","90","","90","","120","","268.93","0.1","293","2","173","1","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Cl Fe N3 O3 -","- Cl Fe N3 O3 -","- Cl2 Fe2 N6 O6 -","2","0.166667","","Trevor W. Hayton; W. Stephen McNeil; Brian O. Patrick; Peter Legzdins","Toward Binary Nitrosyls: Distinctly Bent Fe-N-O Linkages in Base-Stabilized Fe(NO)3+ Complexes","Journal of the American Chemical Society","2003","125","","12935","12944","10.1021/ja036887r","","","0.71069","MoKα","","0.0241","0.0241","","","0.0583","0.0583","","","","","","1.212","","","","has coordinates","178913","2020-10-21","18:00:00",""
"4117966","3.3717","0.00018","3.3717","","5.3855","0.0007","90","","90","","120","","53.022","0.007","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mn O -","- Mn O -","- Mn2 O2 -","2","0.166667","","Ki Min Nam; Yong-Il Kim; Younghun Jo; Seung Mi Lee; Bog G. Kim; Ran Choi; Sang-Il Choi; Hyunjoon Song; Joon T. Park","New Crystal Structure: Synthesis and Characterization of Hexagonal Wurtzite MnO","Journal of the American Chemical Society","2012","134","","8392","8395","10.1021/ja302440y","powder diffraction","","","","","","","","","","","","","1.18","","","","","","","has coordinates","178950","2020-10-21","18:00:00",""
"4118879","8.169","0.007","8.169","0.007","13.411","0.003","90","","90","","120","","775","1","203","2","203","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C7 H18 Br4 Fe N -","- C7 H17.94 Br4 Fe N -","- C14 H35.88 Br8 Fe2 N2 -","2","0.166667","","Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong","Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III)","Journal of the American Chemical Society","2012","134","","18487","18490","10.1021/ja3073319","","","0.71073","MoKα","","0.0591","0.0557","","","0.1594","0.1632","","","","","","1.146","","","","has coordinates","178959","2020-10-21","18:00:00",""
"4118880","8.267","0.002","8.267","0.002","13.524","0.002","90","","90","","120","","800.4","0.3","243","2","243","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C7 H18 Br4 Fe N -","- C7 H17.94 Br4 Fe N -","- C14 H35.88 Br8 Fe2 N2 -","2","0.166667","","Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong","Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III)","Journal of the American Chemical Society","2012","134","","18487","18490","10.1021/ja3073319","","","0.71073","MoKα","","0.0687","0.0612","","","0.1639","0.1712","","","","","","1.108","","","","has coordinates","178959","2020-10-21","18:00:00",""
"4118881","8.265","0.009","8.265","0.009","13.539","0.019","90","","90","","120","","800.9","1.7","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C7 H18 Br4 Fe N -","- C7.018 H17.97 Br4 Fe N -","- C14.036 H35.94 Br8 Fe2 N2 -","2","0.166667","","Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong","Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III)","Journal of the American Chemical Society","2012","134","","18487","18490","10.1021/ja3073319","","","0.71073","MoKα","","0.0738","0.0648","","","0.1638","0.1724","","","","","","1.103","","","","has coordinates","178959","2020-10-21","18:00:00",""
"4118882","8.344","0.009","8.344","0.009","13.67","0.02","90","","90","","120","","824.2","1.7","363","2","363","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C7 H18 Br4 Fe N -","- C7 H20.1 Br4 Fe N -","- C14 H40.2 Br8 Fe2 N2 -","2","0.166667","","Hong-Ling Cai; Yi Zhang; Da-Wei Fu; Wen Zhang; Tao Liu; Hirofumi Yoshikawa; Kunio Awaga; Ren-Gen Xiong","Above-Room-Temperature Magnetodielectric Coupling in a Possible Molecule-Based Multiferroic: Triethylmethylammonium Tetrabromoferrate(III)","Journal of the American Chemical Society","2012","134","","18487","18490","10.1021/ja3073319","","","0.71073","MoKα","","0.1064","0.0813","","","0.1869","0.2063","","","","","","1.139","","","","has coordinates","178959","2020-10-21","18:00:00",""
"4120249","4.7029","0.0008","4.7029","0.0008","7.7921","0.0018","90","","90","","120","","149.25","0.05","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.92 Ca0.89 La0.11 Sb -","- Ag0.919 Ca0.894 La0.106 Sb -","- Ag1.838 Ca1.788 La0.212 Sb2 -","2","0.166667","","Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao","Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance","Journal of the American Chemical Society","2013","135","","11840","11848","10.1021/ja403653m","","","0.71073","MoKα","","0.0287","0.0256","","","0.0607","0.0624","","","","","","1.444","","","","has coordinates","178979","2020-10-21","18:00:00",""
"4120250","4.7023","0.0006","4.7023","0.0006","7.7951","0.0011","90","","90","","120","","149.27","0.03","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.9 Ca0.84 Ce0.16 Sb -","- Ag0.898 Ca0.838 Ce0.162 Sb -","- Ag1.796 Ca1.676 Ce0.324 Sb2 -","2","0.166667","","Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao","Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance","Journal of the American Chemical Society","2013","135","","11840","11848","10.1021/ja403653m","","","0.71073","MoKα","","0.0207","0.0194","","","0.0492","0.0499","","","","","","1.178","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4120251","4.7057","0.0005","4.7057","0.0005","7.788","0.0017","90","","90","","120","","149.35","0.04","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.86 Ca0.87 Pr0.14 Sb -","- Ag0.857 Ca0.865 Pr0.135 Sb -","- Ag1.714 Ca1.73 Pr0.27 Sb2 -","2","0.166667","","Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao","Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance","Journal of the American Chemical Society","2013","135","","11840","11848","10.1021/ja403653m","","","0.71073","MoKα","","0.0253","0.0227","","","0.0545","0.0553","","","","","","1.212","","","","has coordinates","178979","2020-10-21","18:00:00",""
"4120252","4.6931","0.0012","4.6931","0.0012","7.753","0.002","90","","90","","120","","147.88","0.07","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.87 Ca0.86 Nd0.14 Sb -","- Ag0.866 Ca0.859 Nd0.141 Sb -","- Ag1.732 Ca1.718 Nd0.282 Sb2 -","2","0.166667","","Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao","Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance","Journal of the American Chemical Society","2013","135","","11840","11848","10.1021/ja403653m","","","0.71073","MoKα","","0.0297","0.0234","","","0.0441","0.0464","","","","","","1.122","","","","has coordinates","178979","2020-10-21","18:00:00",""
"4120253","4.7008","0.0009","4.7008","0.0009","7.759","0.003","90","","90","","120","","148.48","0.07","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ag0.88 Ca0.83 Sb Sm0.17 -","- Ag0.878 Ca0.832 Sb Sm0.168 -","- Ag1.756 Ca1.664 Sb2 Sm0.336 -","2","0.166667","","Jian Wang; Xiao-Cun Liu; Sheng-Qing Xia; Xu-Tang Tao","Ca1-xRExAg1-ySb (RE = La, Ce, Pr, Nd, Sm; 0 <=x<=1; 0 <=y<=1): Interesting Structural Transformation and Enhanced High-Temperature Thermoelectric Performance","Journal of the American Chemical Society","2013","135","","11840","11848","10.1021/ja403653m","","","0.71073","MoKα","","0.0325","0.0267","","","0.0598","0.0621","","","","","","1.137","","","","has coordinates","178979","2020-10-21","18:00:00",""
"4124615","21.03","","21.03","","8.53","","90","","90","","120","","3267.07","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","K11.52 ((Ga11.52 Si36.48) O96)","","- Ga11.52 K8.88 O96 Si36.48 -","- Ga11.52 K8.88 O96 Si36.48 -","- Ga11.52 K8.88 O96 Si36.48 -","1","0.0833333","","Strohmaier, K.G.; Vaughan, D.E.W.","Structure of the first silicate molecular sieve with 18-ring pore openings, ECR-34","Journal of the American Chemical Society","2003","125","","16035","16039","","","","","","","","","","","","","","","","","","","","","","has coordinates","160072","2020-10-21","18:00:00",""
"4131893","9.514","0.0004","9.514","0.0004","7.0191","0.0005","90","","90","","120","","550.22","0.05","273","2","273","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C4 H11 Br3 Cd Cl N -","- C4.00002 Br3 Cd Cl0.99999 N -","- C8.00004 Br6 Cd2 Cl1.99998 N2 -","2","0.166667","","Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen","Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.","Journal of the American Chemical Society","2018","140","11","3975","3980","10.1021/jacs.7b12524","","","0.71073","MoKα","","0.0802","0.0697","","","0.1937","0.2043","","","","","","1.06","","","","has coordinates","241984","2020-10-21","18:00:00",""
"4131894","9.402","0.002","9.402","0.002","6.977","0.007","90","","90","","120","","534.1","0.6","93","2","93","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C4 H11 Br3 Cd Cl N -","- C4.00002 Br3 Cd Cl0.99996 N -","- C8.00004 Br6 Cd2 Cl1.99992 N2 -","2","0.166667","","Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; You, Yu-Meng; Xiong, Ren-Gen","Competitive Halogen Bond in the Molecular Ferroelectric with Large Piezoelectric Response.","Journal of the American Chemical Society","2018","140","11","3975","3980","10.1021/jacs.7b12524","","","0.71073","MoKα","","0.0625","0.0563","","","0.1479","0.1527","","","","","","1.111","","","","has coordinates","241985","2020-10-21","18:00:00",""
"4132587","14.8607","0.0004","14.8607","0.0004","6.7012","0.0003","90","","90","","120","","1281.63","0.08","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.049","0.0357","","","0.0682","0.0706","","","","","","1.012","","","","has coordinates","242531","2020-10-21","18:00:00",""
"4132588","14.9319","0.0004","14.9319","0.0004","6.7338","0.0002","90","","90","","120","","1300.23","0.06","373","2","373","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.0536","0.0347","","","0.0586","0.0625","","","","","","1.046","","","","has coordinates","242532","2020-10-21","18:00:00",""
"4132589","14.7885","0.0005","14.7885","0.0005","6.6738","0.0003","90","","90","","120","","1264.01","0.08","223","2","223","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.0411","0.0318","","","0.0742","0.0765","","","","","","1.022","","","","has coordinates","242533","2020-10-21","18:00:00",""
"4132590","14.6822","0.0005","14.6822","0.0005","6.6323","0.0003","90","","90","","120","","1238.16","0.08","93","2","93","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.0465","0.0385","","","0.077","0.0789","","","","","","1.07","","","","has coordinates","242534","2020-10-21","18:00:00",""
"4132591","14.8806","0.0005","14.8806","0.0005","6.7146","0.0004","90","","90","","120","","1287.63","0.1","323","2","323","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.0824","0.0466","","","0.0825","0.0858","","","","","","1.03","","","","has coordinates","242535","2020-10-21","18:00:00",""
"4132592","14.747","0.0004","14.747","0.0004","6.6608","0.0003","90","","90","","120","","1254.48","0.07","173","2","173","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.0394","0.0289","","","0.0585","0.0604","","","","","","1.043","","","","has coordinates","242536","2020-10-21","18:00:00",""
"4132593","15.0014","0.0006","15.0014","0.0006","6.7669","0.0003","90","","90","","120","","1318.82","0.09","423","2","423","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H30 Br7 Mn2 N3 -","- C9 H30 Br7 Mn2 N3 -","- C18 H60 Br14 Mn4 N6 -","2","0.166667","","Wei, Zhenhong; Liao, Wei-Qiang; Tang, Yuan-Yuan; Li, Peng-Fei; Shi, Ping-Ping; Cai, Hu; Xiong, Ren-Gen","Discovery of an Antiperovskite Ferroelectric in [(CH<sub>3</sub>)<sub>3</sub>NH]<sub>3</sub>(MnBr<sub>3</sub>)(MnBr<sub>4</sub>).","Journal of the American Chemical Society","2018","140","26","8110","8113","10.1021/jacs.8b05037","","","0.71073","MoKα","","0.0825","0.0427","","","0.0707","0.0774","","","","","","1.048","","","","has coordinates","242537","2020-10-21","18:00:00",""
"4308619","17.34","0.003","17.34","0.003","10.541","0.003","90","","90","","120","","2744.8","1","293","2","293","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","","","- C12 H32 N18 O4 S12 Se4 W4 -","- C12 N21 O3.99 S12 Se4 W4 -","- C24 N42 O7.98 S24 Se8 W8 -","2","0.166667","","M. Sokolov; P. Esparza; R. Hernandez-Molina; J. G. Platas; A. Mederos; J. A. Gavin; R. Llusar; C. Vicent","Preparation and Properties of the Full Series of Cuboidal Clusters [MoxW4-xSe4(H2O)12]n+ (n= 4-6) and Their Derivatives","Inorganic Chemistry","2005","44","","1132","1141","10.1021/ic049298a","","","0.71073","MoKα","","0.0973","0.0672","","","0.1604","0.1885","","","","","","1.106","","","","has coordinates","179124","2020-10-21","18:00:00",""
"4309877","18.6413","0.0008","18.6413","0.0008","12.9868","0.0007","90","","90","","120","","3908.3","0.3","150","2","150","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C9 K5 N9 Se3 Te W3 -","- C9 K5.02 N9 Se3 Te W3 -","- C54 K30.12 N54 Se18 Te6 W18 -","6","0.5","","Maxim N. Sokolov; Pavel A. Abramov; Artem L. Gushchin; Irina V. Kalinina; Dmitry Y. Naumov; Alexander V. Virovets; Eugenia V. Peresypkina; Cristian Vicent; Rosa Llusar; Vladimir P. Fedin","Synthesis and Reactivity of W3Te74+ Clusters and Chalcogen Exchange in the M3Q7 (M = Mo, W; Q = S, Se, Te) Cluster Family","Inorganic Chemistry","2005","44","","8116","8124","10.1021/ic050962c","","x-ray","0.71073","MoKα","","0.1105","0.0615","","","0.1212","0.1476","","","","","","1.124","","","","has coordinates","179136","2020-10-21","18:00:00",""
"4312562","13.549","0.002","13.549","0.002","7.227","0.0017","90","","90","","120","","1149","0.4","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C16 H34.5 Mo N3.5 S3 -","- C16 H36.675 Mo N3.5 S3 -","- C32 H73.35 Mo2 N7 S6 -","2","0.166667","","David V. Partyka; Richard J. Staples; R. H. Holm","Nucleophilic Reactivity and Oxo/Sulfido Substitution Reactions of MVIO3 Groups (M = Mo, W)","Inorganic Chemistry","2003","42","","7877","7886","10.1021/ic030185l","","","0.71073","MoKα","","0.0559","0.051","","","0.1142","0.1173","","","","","","1.035","","","","has coordinates,has disorder","176467","2020-10-21","18:00:00",""
"4312887","7.7281","0.0014","7.7281","0.0014","6.742","0.002","90","","90","","120","","348.71","0.14","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Br3 Cd Cs -","- Br3 Cd Cs -","- Br6 Cd2 Cs2 -","2","0.166667","","Peng Ren; Jingui Qin; Chuangtian Chen","A Novel Nonlinear Optical Crystal for the IR Region: Noncentrosymmetrically Crystalline CsCdBr3 and Its Properties","Inorganic Chemistry","2003","42","","8","10","10.1021/ic025813y","","","0.71073","MoKα","","0.066","0.0558","","","0.1383","0.1524","","","","","","1.063","","","","has coordinates","179167","2020-10-21","18:00:00",""
"4313804","12.7021","0.0018","12.7021","0.0018","4.9966","0.001","90","","90","","120","","698.2","0.2","120","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- As1.33 H1.68 Ni2.16 O6.33 -","- As1.33333 Ni2.16233 O6.33333 -","- As8 Ni12.974 O38 -","6","0.5","","Robert W. Hughes; Lee A. Gerrard; Daniel J. Price; Mark T. Weller","A Hybrid Metalloarsenate 3D Framework-1D Interrupted Metal Oxide","Inorganic Chemistry","2003","42","","4160","4164","10.1021/ic026151f","","","0.71073","MoKα","","0.042","0.0396","","","0.0955","0.0976","","","","","","1.073","","","","has coordinates","192782","2020-10-21","18:00:00",""
"4313805","12.8279","0.0006","12.8279","0.0006","5.0919","0.0002","90","","90","","120","","725.64","0.06","120","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- As1.33 Co2.22 H1.57 O6.33 -","- As1.33333 Co2.21667 O6.33333 -","- As8 Co13.3 O38 -","6","0.5","","Robert W. Hughes; Lee A. Gerrard; Daniel J. Price; Mark T. Weller","A Hybrid Metalloarsenate 3D Framework-1D Interrupted Metal Oxide","Inorganic Chemistry","2003","42","","4160","4164","10.1021/ic026151f","","","0.71073","MoKα","","0.0349","0.0334","","","0.0793","0.0798","","","","","","1.216","","","","has coordinates","192782","2020-10-21","18:00:00",""
"4321633","7.431","0.003","7.431","0.003","9.003","0.004","90","","90","","120","","430.5","0.3","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As2 Cl2 Hg6 S8 -","- As2 Cl2 Hg6 S8 -","- As2 Cl2 Hg6 S8 -","1","0.0833333","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0386","0.037","","0.0985","0.098","","","","1.079","1.118","1.118","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321634","7.43","0.003","7.43","0.003","9.364","0.004","90","","90","","120","","447.7","0.3","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As2 Br2 Hg6 S8 -","- As2 Br2 Hg6 S8 -","- As2 Br2 Hg6 S8 -","1","0.0833333","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0314","0.0304","","0.0954","0.0948","","","","1.176","1.196","1.196","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321635","7.707","0.008","7.707","","9.468","0.011","90","","90","","120","","487","0.8","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As Br Hg3 Se4 -","- As Br Hg3 Se4 -","- As2 Br2 Hg6 Se8 -","2","0.166667","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0433","0.0414","","0.1141","0.1094","","","","1.086","1.06","1.06","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4321636","7.6902","0.0007","7.6902","0.0007","9.9675","0.001","90","","90","","120","","510.5","0.08","293","2","293","2","","","","","","","synthetic","4","P 63 m c","P 6c -2c","186","","","","- As Hg3 I Se4 -","- As Hg3 I Se4 -","- As2 Hg6 I2 Se8 -","2","0.166667","","Johannes Beck; Sylvia Hedderich; Klaus Köllisch","Hg3AsE4X (E = S, Se; X = Cl, Br, I), a Family of Isotypic Compounds with an Acentric, Layered Structure","Inorganic Chemistry","2000","39","","5847","5850","10.1021/ic0003527","","","0.71073","MoKα","","0.0327","0.0317","","0.1052","0.1046","","","","1.435","1.45","1.45","","","","","has coordinates","179319","2020-10-21","18:00:00",""
"4326533","7.43","0.001","7.43","0.001","4.7427","0.0009","90","","90","","120","","226.74","0.06","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- B3 Co Rh6 -","- B3 Co0.999 Rh6.001 -","- B6 Co1.998 Rh12.002 -","2","0.166667","","Patrick R. N. Misse; Michael Gilleßen; Boniface P. T. Fokwa","Site-Preferential Design of Itinerant Ferromagnetic Borides: Experimental and Theoretical Investigation of MRh6B3 (M = Fe, Co)","Inorganic Chemistry","2011","50","","10303","10309","10.1021/ic2013655","","","0.71073","MoKα","","0.0249","0.0238","","","0.0456","0.0458","","","","","","1.132","","","","has coordinates","179368","2020-10-21","18:00:00",""
"4328014","10.3357","0.0003","10.3357","0.0003","8.3534","0.0004","90","","90","","120","","772.81","0.05","173","2","173","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","1-Chlorido-(2,8,9-trioxa-5-aza-3,3,7,7,10,10-hexamethyl- stannatricyclo[3.3.3.01.5]undecane","","- C12 H24 Cl N O3 Sn -","- C12 H24 Cl N O3 Sn -","- C24 H48 Cl2 N2 O6 Sn2 -","2","0.166667","","Thomas Zöller; Christina Dietz; Ljuba Iovkova-Berends; Olga Karsten; Gerrit Bradtmöller; Ann-Kristin Wiegand; Yu Wang; Viatcheslav Jouikov; Klaus Jurkschat","Novel Stannatranes of the Type N(CH2CMe2O)3SnX (X = OR, SR, OC(O)R, SP(S)Ph2, Halogen). Synthesis, Molecular Structures, and Electrochemical Properties","Inorganic Chemistry","2012","51","","1041","1056","10.1021/ic202179e","","","0.71073","MoKα","","0.0173","0.0158","","","0.0405","0.0408","","","","","","1.104","","","","has coordinates","179383","2020-10-21","18:00:00",""
"4329871","15.637","0.004","15.637","0.004","9.351","0.003","90","","90","","120","","1980.1","1","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C43 H54 Ni6 O3 -","- C43 H54 Ni6 O3 -","- C86 H108 Ni12 O6 -","2","0.166667","","Włodzimierz Buchowicz; Beata Herbaczyńska; Lucjan B. Jerzykiewicz; Tadeusz Lis; Stanisław Pasynkiewicz; Antoni Pietrzykowski","Triple C-H Bond Activation of a Nickel-Bound Methyl Group: Synthesis and X-Ray Structure of a Carbide Cluster (NiCp)6(μ6-C)","Inorganic Chemistry","2012","51","","8292","8297","10.1021/ic3008409","","","0.71073","MoKα","","0.1273","0.0682","","","0.1558","0.1804","","","","","","1.03","","","","has coordinates,has disorder","179401","2020-10-21","18:00:00",""
"4330025","10.50502","","10.50502","","6.38831","","90","","90","","120","","610.535","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Ce1.5 La1.5 O15 -","- B2.5 Ca1.4937 Ce0.7551 La0.75555 O7.5 -","- B10 Ca5.9748 Ce3.0204 La3.0222 O30 -","4","0.333333","","Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao","Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation","Inorganic Chemistry","2012","51","","8802","8809","10.1021/ic3006053","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4330026","10.5065","","10.5065","","6.40123","","90","","90","","120","","611.942","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Ce0.9 La2.1 O15 -","- B2.5 Ca1.50045 Ce0.4533 La1.0536 O7.5 -","- B10 Ca6.0018 Ce1.8132 La4.2144 O30 -","4","0.333333","","Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao","Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation","Inorganic Chemistry","2012","51","","8802","8809","10.1021/ic3006053","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4330027","10.50803","","10.50803","","6.41329","","90","","90","","120","","613.273","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Ce0.3 La2.7 O15 -","- B2.5 Ca1.5018 Ce0.1518 La1.35345 O7.5 -","- B10 Ca6.0072 Ce0.6072 La5.4138 O30 -","4","0.333333","","Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao","Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation","Inorganic Chemistry","2012","51","","8802","8809","10.1021/ic3006053","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4330028","10.51116","","10.51116","","6.41455","","90","","90","","120","","613.759","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Ce0.2 La2.8 O15 -","- B2.5 Ca1.50465 Ce0.06165 La1.4382 O7.5 -","- B10 Ca6.0186 Ce0.2466 La5.7528 O30 -","4","0.333333","","Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao","Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation","Inorganic Chemistry","2012","51","","8802","8809","10.1021/ic3006053","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4330029","10.509484","0.000063","10.509484","0.000063","6.418076","0.000072","90","","90","","120","","613.901","0.009","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Ce0.1 La2.9 O15 -","- B2.5 Ca1.50195 Ce0.0147 La1.48845 O7.5 -","- B10 Ca6.0078 Ce0.0588 La5.9538 O30 -","4","0.333333","","Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao","Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation","Inorganic Chemistry","2012","51","","8802","8809","10.1021/ic3006053","","","","","","","","","","","","","","","","","","","","","has coordinates","176467","2020-10-21","18:00:00",""
"4330030","10.50975","","10.50975","","6.41935","","90","","90","","120","","614.054","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 La3 O15 -","- B2.5 Ca1.5 La1.5 O7.5 -","- B10 Ca6 La6 O30 -","4","0.333333","","Chunmeng Liu; Hongbin Liang; Xiaojun Kuang; Jiuping Zhong; Shuaishuai Sun; Ye Tao","Structure Refinement and Two-Center Luminescence of Ca3La3(BO3)5: Ce3+ under VUV-UV Excitation","Inorganic Chemistry","2012","51","","8802","8809","10.1021/ic3006053","","","","","","","","","","","","","","","","","","","","","has coordinates","205493","2020-10-21","18:00:00",""
"4332713","8.3774","0.0011","8.3774","0.0011","13.631","0.004","90","","90","","120","","828.5","0.3","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","04140","","","- C8 H20 Br4 Fe N -","- C8.16 H20.4 Br4 Fe N -","- C16.32 H40.8 Br8 Fe2 N2 -","2","0.166667","","Rohde, Jan-Uwe; Stubna, Audria; Bominaar, Emile L.; Münck, Eckard; Nam, Wonwoo; Que, Lawrence","Nonheme Oxoiron(IV) Complexes of Tris(2-pyridylmethyl)amine withcis-Monoanionic Ligands","Inorganic Chemistry","2006","45","16","6435","6445","10.1021/ic060740u","","","0.71073","MoKα","","0.0448","0.0291","","","0.0655","0.0718","","","","","","1.036","","","","has coordinates,has disorder","179430","2020-10-21","18:00:00",""
"4334358","18.116","0.005","18.116","0.005","10.989","0.005","90","0.005","90","0.005","120","0.005","3123.3","1.9","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C40 H90 Ce3 O11 -","- C40 H96 Ce3 O11 -","- C80 H192 Ce6 O22 -","2","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","","0.0619","0.0345","","","0.0895","0.0968","","","","","","0.855","","","","has coordinates","179446","2020-10-21","18:00:00",""
"4335640","8.6603","0.0014","8.6603","0.0014","7.9022","0.0006","90","","90","","120","","513.27","0.12","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","delta-Formamidinium_Lead_Iodide","","","- C H5 I3 N2 Pb -","- C I3 N2.01 Pb -","- C2 I6 N4.02 Pb2 -","2","0.166667","","Constantinos C. Stoumpos; Christos D. Malliakas; Mercouri G. Kanatzidis","Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties","Inorganic Chemistry","2013","52","","9019","9038","10.1021/ic401215x","","","0.71073","MoKα","","0.0516","0.0437","","","0.1066","0.1102","","","","","","1.055","","","","has coordinates","179459","2020-10-21","18:00:00",""
"4340466","10.0845","0.0005","10.0845","0.0005","12.7055","0.0012","90","","90","","120","","1119","0.13","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C8 Ca5 Cs Na5 O24 -","- C8 Ca4.99 Cs Na5.01 O23.98 -","- C16 Ca9.98 Cs2 Na10.02 O47.96 -","2","0.166667","","Luo, Min; Wang, GenXiang; Lin, Chensheng; Ye, Ning; Zhou, Yuqiao; Cheng, Wendan","Na4La2(CO3)5 and CsNa5Ca5(CO3)8: Two New Carbonates as UV Nonlinear Optical Materials.","Inorganic chemistry","2014","53","15","8098","","10.1021/ic501089f","","","0.71073","MoKα","","0.0404","0.0386","","","0.0913","0.093","","","","","","1.149","","","","has coordinates","278046","2022-09-21","15:45:41",""
"4340467","10.55","0.02","10.55","0.02","6.47","0.02","90","","90","","120","","624","3","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C5 La2 Na4 O15 -","- C5 La2.01 Na3.99 O15 -","- C10 La4.02 Na7.98 O30 -","2","0.166667","","Luo, Min; Wang, GenXiang; Lin, Chensheng; Ye, Ning; Zhou, Yuqiao; Cheng, Wendan","Na4La2(CO3)5 and CsNa5Ca5(CO3)8: Two New Carbonates as UV Nonlinear Optical Materials.","Inorganic chemistry","2014","53","15","8098","","10.1021/ic501089f","","","0.71073","MoKα","","0.0582","0.0562","","","0.1211","0.1227","","","","","","1.294","","","","has coordinates","278046","2022-09-21","15:45:41",""
"4341700","10.866","0.005","10.866","0.005","11.919","0.008","90","","90","","120","","1218.7","1.1","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","Ba2Ga8SiS16","","","- Ba2 Ga8 S16 Si -","- Ba2 Ga7.98 S16 Si1.02 -","- Ba4 Ga15.96 S32 Si2.04 -","2","0.166667","","Liu, Bin-Wen; Zeng, Hui-Yi; Zhang, Ming-Jian; Fan, Yu-Hang; Guo, Guo-Cong; Huang, Jin-Shun; Dong, Zhen-Chao","Syntheses, Structures, and Nonlinear-Optical Properties of Metal Sulfides Ba2Ga8MS16 (M = Si, Ge).","Inorganic chemistry","2015","54","3","976","981","10.1021/ic502362f","","","0.71073","MoKα","","0.0248","0.023","","","0.0463","0.0469","","","","","","1.062","","","","has coordinates","179520","2020-10-21","18:00:00",""
"4341701","10.8868","0.0004","10.8868","0.0004","11.9152","0.0007","90","","90","","120","","1223.02","0.1","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","Ba2Ga8GeS16","","","- Ba2 Ga8 Ge S16 -","- Ba2 Ga7.98 Ge1.02 S16 -","- Ba4 Ga15.96 Ge2.04 S32 -","2","0.166667","","Liu, Bin-Wen; Zeng, Hui-Yi; Zhang, Ming-Jian; Fan, Yu-Hang; Guo, Guo-Cong; Huang, Jin-Shun; Dong, Zhen-Chao","Syntheses, Structures, and Nonlinear-Optical Properties of Metal Sulfides Ba2Ga8MS16 (M = Si, Ge).","Inorganic chemistry","2015","54","3","976","981","10.1021/ic502362f","","","0.71073","MoKα","","0.0164","0.015","","","0.0272","0.028","","","","","","1.039","","","","has coordinates","179520","2020-10-21","18:00:00",""
"4342327","10.0121","0.0005","10.0121","0.0005","7.6045","0.0008","90","","90","","120","","660.16","0.08","200","2","200","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al Ca3 Na3 Sb4 -","- Al Ca3 Na3 Sb4 -","- Al2 Ca6 Na6 Sb8 -","2","0.166667","","Wang, Yi; Stoyko, Stanislav; Bobev, Svilen","Quaternary Pnictides with Complex, Noncentrosymmetric Structures. Synthesis and Structural Characterization of the New Zintl Phases Na11Ca2Al3Sb8, Na4CaGaSb3, and Na15Ca3In5Sb12.","Inorganic chemistry","2015","54","4","1931","1939","10.1021/ic502822v","","","0.71073","MoKα","","0.0419","0.0307","","","0.0547","0.0572","","","","","","0.953","","","","has coordinates","179526","2020-10-21","18:00:00",""
"4342920","5.5929","0.0001","5.5929","0.0001","12.2326","0.0002","90","","90","","120","","331.378","0.01","298","0.2","298","0.2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- O6 Rb Sc Se2 -","- O6 Rb Sc Se2 -","- O12 Rb2 Sc2 Se4 -","2","0.166667","","Song, Seung Yoon; Ok, Kang Min","Modulation of Framework and Centricity: Cation Size Effect in New Quaternary Selenites, ASc(SeO3)2 (A = Na, K, Rb, and Cs).","Inorganic chemistry","2015","54","10","5032","5038","10.1021/acs.inorgchem.5b00653","","x-ray","0.71073","MoKα","","0.0278","0.0198","","","0.0351","0.0365","","","","","","0.954","","","","has coordinates","138113","2020-10-21","18:00:00",""
"4343168","10.519","0.016","10.519","","8.9","0.013","90","","90","","120","","852.8","1.8","298","2","298","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C3 H3 B O16 Pb7 -","- C6 H3 B O16 Pb7 -","- C12 H6 B2 O32 Pb14 -","2","0.166667","","Abudoureheman, Maierhaba; Wang, Li; Zhang, Xianming; Yu, Hongwei; Yang, Zhihua; Lei, Chen; Han, Jian; Pan, Shilie","Pb7O(OH)3(CO3)3(BO3): First Mixed Borate and Carbonate Nonlinear Optical Material Exhibiting Large Second-Harmonic Generation Response.","Inorganic chemistry","2015","54","8","4138","4142","10.1021/acs.inorgchem.5b00401","","","0.71073","MoKα","","0.0421","0.0378","","","0.0958","0.0982","","","","","","1.097","","","","has coordinates","137923","2020-10-21","18:00:00",""
"4343181","7.242","0.0003","7.242","0.0003","11.8152","0.0007","90","","90","","120","","536.65","0.04","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- Cs F3 O9 Se2 Ti3 -","- Cs F3 O9 Se2 Ti3 -","- Cs2 F6 O18 Se4 Ti6 -","2","0.166667","","Cao, Xue-Li; Hu, Chun-Li; Kong, Fang; Mao, Jiang-Gao","Cs(TaO2)3(SeO3)2 and Cs(TiOF)3(SeO3)2: Structural and Second Harmonic Generation Changes Induced by the Different d(0)-TM Coordination Octahedra.","Inorganic chemistry","2015","54","8","3875","3882","10.1021/acs.inorgchem.5b00052","","","0.71073","MoKα","","0.0269","0.0228","","","0.0488","0.0512","","","","","","1.068","","","","has coordinates","176428","2020-10-21","18:00:00",""
"4343381","3.7519","0.0002","3.7519","0.0002","11.349","0.001","90","","90","","120","","138.354","0.016","293","","293","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Ca Fe O S -","- Ca Fe O S -","- Ca2 Fe2 O2 S2 -","2","0.166667","","Delacotte, Charlène; Pérez, Olivier; Pautrat, Alain; Berthebaud, David; Hébert, Sylvie; Suard, Emmanuelle; Pelloquin, Denis; Maignan, Antoine","Magnetodielectric Effect in Crystals of the Noncentrosymmetric CaOFeS at Low Temperature.","Inorganic chemistry","2015","54","13","6560","6565","10.1021/acs.inorgchem.5b00879","","x-ray","0.71073","MoKα","","0.0289","0.0258","","","0.0918","0.1096","","","","1.5","1.5","1.72","","","","has coordinates","176429","2020-10-21","18:00:00",""
"4344372","4.351","","4.351","","6.622","","90","","90","","120","","108.567","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ir Si3 -","- Ir Si3 -","- Ir2 Si6 -","2","0.166667","","White, J.G.; Hockings, E.F.","Crystal Structure of Iridium Trisilicide, Ir Si3","Inorganic Chemistry","1971","10","","1934","1935","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344484","13.1524","","13.1524","","17.3122","","90","","90","","120","","2593.54","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Al5.1 Ba44.52 Cu23.23 O83.84 -","- Al5.1 Ba44.516 Cu23.232 O83.84 -","- Al5.1 Ba44.516 Cu23.232 O83.84 -","1","0.0833333","","VerNooy, P.D.; Dixon, M.A.; Stacy, A.M.; Hollander, F.J.","Novel Cu6 O15 ""bowls"" in seven new barium copper oxides: M6 Ba46 Cu24 O84 (M= Al, Si, TI, Fe, Ga, Ge, Zr)","Inorganic Chemistry","1990","29","","2837","2841","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"4344956","8.966","0.0007","8.966","0.0007","23.079","0.002","90","","90","","120","","1606.7","0.2","293","","293","","","","","","","","","5","P 63 m c","P 6c -2c","186","Ethylammonium Tin Iodide","","","- C2 H8 I3 N Sn -","- C1.9999 I3 N Sn -","- C11.9994 I18 N6 Sn6 -","6","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","","0.108","0.0876","","","0.0965","0.1","","","","1.99","1.99","1.82","","","","has coordinates","191346","2020-10-21","18:00:00",""
"4344991","7.4396","0.0011","7.4396","0.0011","4.742","0.0007","90","","90","","120","","227.3","0.06","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- B3 Fe0.86 Rh5.12 Ru1.02 -","- B3 Fe0.859 Rh1.0337 Ru5.107 -","- B6 Fe1.718 Rh2.0674 Ru10.214 -","2","0.166667","","Shankhari, Pritam; Misse, Patrick R. N.; Mbarki, Mohammed; Park, Hyounmyung; Fokwa, Boniface P. T.","Chemical Tuning of Magnetic Properties through Ru/Rh Substitution in Th7Fe3-type FeRh6-nRunB3 (n = 1-5) Series.","Inorganic chemistry","2016","","","","","10.1021/acs.inorgchem.6b02341","","","0.71073","MoKα","","0.02","0.0184","","","0.0326","0.033","","","","","","1.132","","","","has coordinates","189565","2020-10-21","18:00:00",""
"4349390","7.6227","0.0005","7.6227","0.0005","12.280488","","90","","90","","120","","617.97","0.06","805","","805","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","?h-NaCs(B12H12)?","- B12 Cs H12 Na -","- B12 Cs H12 Na -","- B24 Cs2 H24 Na2 -","2","0.166667","","Sadikin, Yolanda; Schouwink, Pascal; Brighi, Matteo; Łodziana, Zbigniew; Černý, Radovan","Modified Anion Packing of Na<sub>2</sub>B<sub>12</sub>H<sub>12</sub> in Close to Room Temperature Superionic Conductors.","Inorganic chemistry","2017","56","9","5006","5016","10.1021/acs.inorgchem.7b00013","powder diffraction","","0.69852","synchrotron","","","","","","","","","0.05","17","","","","","","","has coordinates","233925","2020-10-21","18:00:00",""
"4349391","7.0722","0.0003","7.0722","0.0003","11.9592","0.0006","90","","90","","120","","518.01","0.04","570","","570","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","?h-LiK(B12H12)?","- B12 H12 K0.41 Li1.59 -","- B12 H12 K0.409 Li1.591 -","- B24 H24 K0.818 Li3.182 -","2","0.166667","","Sadikin, Yolanda; Schouwink, Pascal; Brighi, Matteo; Łodziana, Zbigniew; Černý, Radovan","Modified Anion Packing of Na<sub>2</sub>B<sub>12</sub>H<sub>12</sub> in Close to Room Temperature Superionic Conductors.","Inorganic chemistry","2017","56","9","5006","5016","10.1021/acs.inorgchem.7b00013","powder diffraction","","0.81984","synchrotron","","","","","","","","","0.07","16","","","","","","","has coordinates","233926","2020-10-21","18:00:00",""
"4500111","13.5715","0.0017","13.5715","0.0017","8.7125","0.0012","90","","90","","120","","1389.7","0.3","213","2","213","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","","","- C15 H36 Cu3 Mo N7 O4 S3 -","- C15 H36 Cu3 Mo N7 O4 S3 -","- C30 H72 Cu6 Mo2 N14 O8 S6 -","2","0.166667","","Zhang, Jinfang; Meng, Suci; Song, Yinglin; Zhou, Yimeng; Cao, Yuan; Li, Jianghua; Zhao, Huajian; Hu, Jingchun; Wu, Jinhua; Humphrey, Mark G.; Zhang, Chi","Syntheses, Structural, Theoretical, and Nonlinear Optical Studies of Non-Interpenetrating Three-Dimensional Nest-Shaped-Cluster [MoOS3Cu3]-Based Coordination Polymers","Crystal Growth & Design","2011","11","1","100","","10.1021/cg1009779","","","0.7107","MoKα","","0.0292","0.0291","","","0.0785","0.0785","","","","","","1.117","","","","has coordinates","179532","2020-10-21","18:00:00",""
"4506372","10.87255","0.00018","10.87255","0.00018","6.94718","0.00011","90","","90","","120","","711.22","0.02","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","Barium Strontium Fluoride Borate","","","- B3.65 Ba3.12 F3.05 O10.95 Sr3.88 -","- B3.648 Ba3.118 F3.072 O10.94 Sr3.882 -","- B7.296 Ba6.236 F6.144 O21.88 Sr7.764 -","2","0.166667","","Rashchenko, S. V.; Bekker, T. B.; Bakakin, V. V.; Seryotkin, Yu. V.; Shevchenko, V. S.; Kokh, A. E.; Stonoga, S. Yu.","New Fluoride Borate Solid‒Solution Series Ba4‒xSr3+x(BO3)4‒yF2+3y","Crystal Growth & Design","2012","12","6","2955","","10.1021/cg3004933","","x-ray","0.71073","MoKα","","0.0376","0.0346","","","0.0828","0.0844","","","","","","1.101","","","","has coordinates","179599","2020-10-21","18:00:00",""
"4509252","10.8953","0.0016","10.8953","0.0016","6.9381","0.0015","90","","90","","120","","713.3","0.2","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B3 Ba3 F5 O9 Sr4 -","- B3 Ba3 F5 O9 Sr4 -","- B6 Ba6 F10 O18 Sr8 -","2","0.166667","","Zhang, Guochun; Liu, Zuoliang; Zhang, Jianxiu; Fan, Feidi; Liu, Youchen; Fu, Peizhen","Crystal Growth, Structure, and Properties of a Non-Centrosymmetric Fluoride Borate, Ba3Sr4(BO3)3F5","Crystal Growth & Design","2009","9","7","3137","","10.1021/cg801124z","","","0.71073","MoKα","","0.0523","0.0505","","","0.1377","0.1394","","","","","","1.132","","","","has coordinates","179628","2020-10-21","18:00:00",""
"4513415","11.5255","","11.5255","","6.9634","","90","","90","","120","","801.072","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","Nd2 Ba3.259 Sr0.073 Cu0.667 Al2 O10","","- Al2 Ba3.259 Cu0.667 Nd2 O10 Sr0.073 -","- Al2 Ba3.25867 Cu0.666667 Nd2 O10 Sr0.0733333 -","- Al6 Ba9.776 Cu2 Nd6 O30 Sr0.22 -","3","0.25","","Scavini, M.; Mele, P.; Costa, G.A.; Ferretti, M.","Growth and structural characterization of needlelike metastable crystals in the Nd-Ba-Cu-(Al)-O system","Crystal Growth and Design","2004","4","","1259","1263","","","","","","","","","","","","","","","","","","","","","","has coordinates","151586","2020-10-21","18:00:00",""
"4514294","10.37402","0.00014","10.37402","0.00014","6.25935","0.00009","90","","90","","120","","583.383","0.014","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","disodium tetracalcium pentacarbonate","","- C5 Ca4 Na2 O15 -","- C5 Ca3.9999 Na2.0001 O15 -","- C10 Ca7.9998 Na4.0002 O30 -","2","0.166667","","Rashchenko, Sergey V.; Bakakin, Vladimir V.; Shatskiy, Anton F.; Gavryushkin, Pavel N.; Seryotkin, Yurii V.; Litasov, Konstantin D.","Noncentrosymmetric Na2Ca4(CO3)5 Carbonate of “M13M23XY3Z” Structural Type and Affinity between Borate and Carbonate Structures for Design of New Optical Materials","Crystal Growth & Design","2017","17","11","6079","","10.1021/acs.cgd.7b01161","","","0.71073","MoKα","","0.0205","0.0199","","","0.0499","0.0505","","","","","","1.155","","","","has coordinates","203308","2020-10-21","18:00:00",""
"4515349","23.3072","0.0003","23.3072","0.0003","21.8206","0.0009","90","","90","","120","","10265.4","0.5","173.01","0.1","173.01","0.1","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C42 H21 N3 O16 Zr3 -","- C42 H21 N3 O16 Zr3 -","- C168 H84 N12 O64 Zr12 -","4","0.333333","","He, Tao; Zhang, Yong-Zheng; Kong, Xiang-Jing; Yu, Jiamei; Lv, Xiu-Liang; Wu, Yufeng; Guo, Zhen-Ji; Li, Jian-Rong","Zr(IV)-Based Metal-Organic Framework with T-Shaped Ligand: Unique Structure, High Stability, Selective Detection, and Rapid Adsorption of Cr<sub>2</sub>O<sub>7</sub><sup>2-</sup> in Water.","ACS applied materials & interfaces","2018","10","19","16650","16659","10.1021/acsami.8b03987","","x-ray","1.54184","CuKα","","0.0818","0.0703","","","0.1909","0.2088","","","","","","0.829","","","","has coordinates","225507","2020-10-21","18:00:00",""
"4515449","16.6968","0.0009","16.6968","0.0009","18.9684","0.001","90","","90","","120","","4579.6","0.4","200","2","200","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C45 H30 Br Co3 N15 O7 -","- C45 H30 Br1.0002 Co3 N15 O7 -","- C90 H60 Br2.0004 Co6 N30 O14 -","2","0.166667","","Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee","Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities.","ACS applied materials & interfaces","2019","11","3","3181","3188","10.1021/acsami.8b15946","","","0.71073","MoKα","","0.0469","0.0368","","","0.0941","0.0988","","","","","","1.004","","","","has coordinates,has disorder","225603","2020-10-21","18:00:00",""
"4515450","16.8384","0.001","16.8384","0.001","19.0516","0.0013","90","","90","","120","","4678","0.5","200","2","200","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C46 H30 Co3 N16 O7 S -","- C46.002 H30 Co3 N16.002 O7 S1.001 -","- C92.004 H60 Co6 N32.004 O14 S2.002 -","2","0.166667","","Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee","Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities.","ACS applied materials & interfaces","2019","11","3","3181","3188","10.1021/acsami.8b15946","","","0.71073","MoKα","","0.0754","0.0644","","","0.1459","0.1539","","","","","","1.072","","","","has coordinates,has disorder","225604","2020-10-21","18:00:00",""
"4515451","16.7567","0.0005","16.7567","0.0005","19.0343","0.0007","90","","90","","120","","4628.5","0.3","200","2","200","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C45 H30 Co3 N16 O10 -","- C45 H30 Co3 N16.0002 O10.0006 -","- C90 H60 Co6 N32.0004 O20.0012 -","2","0.166667","","Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee","Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities.","ACS applied materials & interfaces","2019","11","3","3181","3188","10.1021/acsami.8b15946","","","0.71073","MoKα","","0.048","0.0404","","","0.088","0.0923","","","","","","1.045","","","","has coordinates,has disorder","225605","2020-10-21","18:00:00",""
"4515452","16.7599","0.0005","16.7599","0.0005","29.0651","0.0009","90","","90","","120","","7070.4","0.4","200","2","200","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","","","- C63 H42 B Co3 F4 N15 O7 -","- C67.23 H42 B Co3 F4 N15 O7 -","- C134.46 H84 B2 Co6 F8 N30 O14 -","2","0.166667","","Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee","Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities.","ACS applied materials & interfaces","2019","11","3","3181","3188","10.1021/acsami.8b15946","","","0.71073","MoKα","","0.0551","0.0501","","","0.1168","0.1188","","","","","","1.103","","","","has coordinates,has disorder","225606","2020-10-21","18:00:00",""
"4515453","16.6267","0.0003","16.6267","0.0003","28.9795","0.0007","90","","90","","120","","6938","0.2","200","2","200","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C63 H42 Co3 N16 O10 -","- C63 H42 Co3 N16.0002 O10.0006 -","- C126 H84 Co6 N32.0004 O20.0012 -","2","0.166667","","Brunet, Gabriel; Robeyns, Koen; Huynh, Racheal P. S.; Lin, Jian-Bin; Collins, Sean P.; Facey, Glenn A.; Shimizu, George K. H.; Woo, Tom K.; Murugesu, Muralee","Design Strategy for the Controlled Generation of Cationic Frameworks and Ensuing Anion-Exchange Capabilities.","ACS applied materials & interfaces","2019","11","3","3181","3188","10.1021/acsami.8b15946","","","0.71073","MoKα","","0.0333","0.0329","","","0.0715","0.0717","","","","","","1.033","","","","has coordinates,has disorder","225607","2020-10-21","18:00:00",""
"5910170","5.835","","5.835","","10.815","","90","","90","","120","","318.889","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Cd2 Mo3 O8 -","","","","","","Wyckoff, R. W. G.","Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","467","467","","","","","","","","","","","","","","","","","","","","","","","177123","2020-10-21","18:00:00",""
"5910193","5.775","","5.775","","9.915","","90","","90","","120","","286.37","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mo3 O8 Zn2 -","- Mo36 O80 Zn8 -","- Mo36 O80 Zn8 -","","","","Wyckoff, R. W. G.","Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","467","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910201","3.226","","3.226","","31.7","","90","","90","","120","","285.706","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- C3 Al7 N3 -","- C10 Al28 N12 -","- C10 Al28 N12 -","","","","Wyckoff, R. W. G.","Pages 9 & 10 from the Structure of Crystals, vol. 4 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","4","","9","10","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910206","5.795","","5.795","","10.267","","90","","90","","120","","298.594","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mn2 Mo3 O8 -","- Mn8 Mo36 O80 -","- Mn8 Mo36 O80 -","","","","Wyckoff, R. W. G.","Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","467","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910226","5.752","","5.752","","9.865","","90","","90","","120","","282.661","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mo3 Ni2 O8 -","- Mo36 Ni8 O80 -","- Mo36 Ni8 O80 -","","","","Wyckoff, R. W. G.","Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","467","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"5910324","5.767","","5.767","","9.915","","90","","90","","120","","285.577","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Co2 Mo3 O8 -","- Co8 Mo36 O80 -","- Co8 Mo36 O80 -","","","","Wyckoff, R. W. G.","Page 467 from the Structure of Crystals, vol. 3 by Wyckoff R W G. published by Interscience Publishers, Inc. in 1951","The Structure of Crystals","1951","3","","467","467","","","","","","","","","","","","","","","","","","","","","","has coordinates","177123","2020-10-21","18:00:00",""
"6000373","6.0039","","6.0039","","15.8203","","90","","90","","120","","493.87","","","","","","","","","","","","","4","P 63 m c","","","","","","- Li Mo2 O8 Tl3 -","","","","","","Xuriguera, A. M.; Justin, C. C.; Elfakir, A.; Quarton, M.","Crystal and powder neutron diffraction data of Tl3Li(MO4)(2) (M = Mo, W)","Powder Diffraction","1998","13","","244","245","10.1017/S0885715600010186","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"6000374","6.0348","","6.0348","","15.8176","","90","","90","","120","","498.89","","","","","","","","","","","","","4","P 63 m c","","","","","","- Li O8 Tl3 W2 -","","","","","","Xuriguera, A. M.; Justin, C. C.; Elfakir, A.; Quarton, M.","Crystal and powder neutron diffraction data of Tl3Li(MO4)(2) (M = Mo, W)","Powder Diffraction","1998","13","","244","245","10.1017/S0885715600010186","","","","","","","","","","","","","","","","","","","","","","176292","2020-10-21","18:00:00",""
"7014819","8.2737","0.0008","8.2737","0.0008","13.4002","0.0013","90","","90","","120","","794.4","0.13","293","2","293","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","","","- C4 H22.4 Cu K N4 O11.2 Zn -","- C4 Cu N4 Zn -","- C8 Cu2 N8 Zn2 -","2","0.166667","","Dan, Hiroki; Nishikiori, Shin-ichi; Yamamuro, Osamu","Tridymite-like host clathrate [K(H2O)n][CuZn(CN)4]: crystal structure, guest molecular motion and properties.","Dalton transactions (Cambridge, England : 2003)","2011","40","5","1168","1174","10.1039/c0dt01201g","","","0.710747","MoKα","","","0.049","","","","0.151","","","","","","1.044","","","","has coordinates","179852","2020-10-21","18:00:00",""
"7022774","15.9295","0.0005","15.9295","0.0005","19.72","0.0007","90","","90","","120","","4333.5","0.2","200","2","200","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H8.92 Co N3 O4.38 -","- C9 H8.92 Co N3 O4.38333 -","- C54 H53.52 Co6 N18 O26.3 -","6","0.5","","Aharen, Tomoko; Habib, Fatemah; Korobkov, Ilia; Burchell, Tara J.; Guillet-Nicolas, Rémy; Kleiz, Fredy; Murugesu, Muralee","Novel Co-based metal-organic frameworks and their magnetic properties using asymmetrically binding 4-(4'-carboxyphenyl)-1,2,4-triazole.","Dalton transactions (Cambridge, England : 2003)","2013","42","21","7795","7802","10.1039/c3dt33000a","","","0.71073","MoKα","","0.0784","0.0564","","","0.1492","0.1749","","","","","","1.054","","","","has coordinates,has disorder","179932","2020-10-21","18:00:00",""
"7023550","7.2447","0.0014","7.2447","0.0014","11.96","0.004","90","","90","","120","","543.6","0.2","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- As Cl4 Ga Hg3 S -","- As Cl4 Ga Hg3 S -","- As2 Cl8 Ga2 Hg6 S2 -","2","0.166667","","Jiang, Xiao-Ming; Li, Xiao-Guo; Fan, Yu-Hang; Liu, Bin-Wen; Zeng, Hui-Yi; Guo, Guo-Cong","New mercury-contained cationic frameworks stabilized by (GaCl4)(-) unit via weak electrostatic forces in supramolecular compounds (Hg11P4)(GaCl4)4 and (Hg3AsS)(GaCl4).","Dalton transactions (Cambridge, England : 2003)","2013","42","43","15475","15481","10.1039/c3dt51451j","","","0.71073","MoKα","","0.0382","0.0364","","","0.1002","0.1022","","","","","","1.073","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7026499","6.141","0.003","6.141","0.003","9.948","0.006","90","","90","","120","","324.9","0.3","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- K O7 Sb Zn4 -","- K O7 Sb Zn4 -","- K2 O14 Sb2 Zn8 -","2","0.166667","","Yang, Song-Lin; Cheng, Wen-Dan; Zhang, Hao; Lin, Chen-Sheng; Zhang, Wei-Long; He, Zhang-Zhen","KZn(4)SbO(7) and KZn(4)Sb(3)O(12): syntheses, structures and photophysics of Sb(5+) control materials.","Dalton transactions (Cambridge, England : 2003)","2010","39","40","9547","9553","10.1039/c0dt00479k","","","0.71073","MoKα","","0.0253","0.0235","","","0.0528","0.0537","","","","","","1.052","","","","has coordinates","179970","2020-10-21","18:00:00",""
"7027413","14.247","0.006","14.247","0.006","6.415","0.003","90","","90","","120","","1127.6","0.9","150","2","150","2","","","","","","","","5","P 63 m c","P 6c -2c","186","Copper Bromide Triazine","1,3,5-triazine tris(copper(I) bromide)","","- C6 H6 Br4 Cu4 N6 -","- C6 H6 Br4 Cu4 N6 -","- C18 H18 Br12 Cu12 N18 -","3","0.25","","Blake, Alexander J.; Brooks, Neil R.; Champness, Neil R.; Cooke, Paul A.; Deveson, Anne M.; Fenske, Dieter; Hubberstey, Peter; Li, Wan-Sheung; Schröder, Martin","Controlling copper(I) halide framework formation using N-donor bridging ligand symmetry: use of 1,3,5-triazine to construct architectures with threefold symmetry","Journal of the Chemical Society, Dalton Transactions","1999","","13","2103","","10.1039/a902290b","","","0.71073","MoKα","","0.0376","0.0328","","","0.0791","0.0819","","","","","","1.109","","","","has coordinates","211332","2020-10-21","18:00:00",""
"7032014","9.2201","0.0011","9.2201","0.0011","6.5289","0.0008","90","","90","","120","","480.66","0.1","100","1","100","1","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C6 H15 Sb Se -","- C6 H15 Sb Se -","- C12 H30 Sb2 Se2 -","2","0.166667","","Heimann, Stefan; Bläser, Dieter; Wölper, Christoph; Haack, Rebekka; Jansen, Georg; Schulz, Stephan","The bonding situation in triethylchalcogenostiboranes - polarized single bonds vs. double bonds.","Dalton transactions (Cambridge, England : 2003)","2014","43","39","14772","14777","10.1039/c4dt01940g","","","0.71073","MoKα","","0.0197","0.0195","","","0.0494","0.0495","","","","","","1.228","","","","has coordinates,has disorder","180026","2020-10-21","18:00:00",""
"7035138","12.63","0.003","12.63","0.003","5.017","0.001","90","","90","","120","","693.1","0.3","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","Cobalt sodium phosphate","Cobalt sodium phosphate hydroxide","","- Co12 H10.18 Na1.82 O38 P8 -","- Co12 H10.14 Na1.82 O38 P8 -","- Co12 H10.14 Na1.82 O38 P8 -","1","0.0833333","","Yakubovich, Olga V.; Kiriukhina, Galina V.; Dimitrova, Olga V.; Shvanskaya, Larisa V.; Volkova, Olga S.; Vasiliev, Alexander N.","A novel cobalt sodium phosphate hydroxide with the ellenbergerite topology: crystal structure and physical properties.","Dalton transactions (Cambridge, England : 2003)","2015","44","26","11827","11834","10.1039/c5dt00753d","","","0.71073","MoKα","","0.0554","0.052","","","0.0737","0.0747","","","","","","1.278","","","","has coordinates","143480","2020-10-21","18:00:00",""
"7038805","16.679","0.002","16.679","0.002","19.05","0.004","90","","90","","120","","4589.5","1.2","113","2","113","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C45 H30 Co3 N15 O7 -","- C45 H30 Co3 N15 O7 -","- C90 H60 Co6 N30 O14 -","2","0.166667","","Gao, Qiang; Zhao, Xiao-Lin; Chang, Ze; Xu, Jian; Bu, Xian-He","Structural stabilization of a metal-organic framework for gas sorption investigation.","Dalton transactions (Cambridge, England : 2003)","2016","45","16","6830","6833","10.1039/c6dt00640j","","","0.71073","MoKα","","0.0734","0.0641","","","0.1621","0.1691","","","","","","1.077","","","","has coordinates","182724","2020-10-21","18:00:00",""
"7038905","10.1136","0.0014","10.1136","0.0014","6.7485","0.0013","90","","90","","120","","597.79","0.16","293","2","293","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","Na3Y3(BO3)4","","- B4 Na3 O12 Y3 -","- B4 Na3 O12 Y3 -","- B8 Na6 O24 Y6 -","2","0.166667","","Shan, Faxian; Kang, Lei; Zhang, Guochun; Yao, Jiyong; Lin, Zheshuai; Xia, Mingjun; Zhang, Xinyuan; Fu, Ying; Wu, Yicheng","Na3Y3(BO3)4: a new noncentrosymmetric borate with an open-framework structure.","Dalton transactions (Cambridge, England : 2003)","2016","45","17","7205","7208","10.1039/c6dt00950f","","","0.71073","MoKα","","0.0596","0.0481","","","0.1097","0.1143","","","","","","0.906","","","","has coordinates","182747","2020-10-21","18:00:00",""
"7043283","12.9234","0.0004","12.9234","0.0004","9.8515","0.0003","90","","90","","120","","1424.91","0.08","105","2","105","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C15 H30 N3 O19 V6 -","- C15 H30 N3 O19 V6 -","- C30 H60 N6 O38 V12 -","2","0.166667","","Wei, Yongge; Xiao, Zicheng; Hu, Xunliang; Hu, Xiaokang; Huang, Bo; Cheng, Min; Wu, Pingfan; Lin, Xinjun","Syntheses and post-functionalization of tri-substituted polyalkoxohexavanadates containing tris(alkoxo) ligands","Dalton Trans.","2017","","","","","10.1039/C7DT01543G","","","0.71073","MoKα","","0.0284","0.0268","","","0.0724","0.0734","","","","","","1.083","","","","has coordinates,has disorder","197729","2020-10-21","18:00:00",""
"7047696","9.7459","0.0007","9.7459","0.0007","14.2773","0.0011","90","","90","","120","","1174.41","0.15","293","2","293","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C6 H15 Br6 N2 O0.5 Pb -","- C6 Br6 N2 O Pb -","- C12 Br12 N4 O2 Pb2 -","2","0.166667","","Song, Jun-Ling; Chen, Wen-Jun; Chu, Kai-Bin; Zhou, Yu-Hua","A facile synthesis of two new IR optical perovskites based on 1,4-diazabicyclo[2,2,2]octane with a high laser damage threshold.","Dalton transactions (Cambridge, England : 2003)","2018","47","41","14497","14502","10.1039/c8dt03047b","","","0.71073","MoKα","","0.074","0.0623","","","0.1345","0.1444","","","","","","1.139","","","","has coordinates","229344","2020-10-21","18:00:00",""
"7055226","10.4864","0.0002","10.4864","0.0002","6.2665","0.0001","90","","90","","120","","596.772","0.019","296","2","296","2","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- B5 Ca3 Nd3 O15 -","- B5 Ca3 Nd3 O15 -","- B10 Ca6 Nd6 O30 -","2","0.166667","","Wang, Xing; Xia, Mingjun; Li, R. K.","Two potential self-activated orthoborates Cd4NdO(BO3)3and Ca3Nd3(BO3)5: growth, crystal structures and optical properties","New J. Chem.","2016","40","3","2057","","10.1039/C5NJ02710A","","","0.71073","MoKα","","0.0245","0.0245","","","0.0584","0.0584","","","","","","1.191","","","","has coordinates","181759","2020-10-21","18:00:00",""
"7062929","13.1893","0.0005","13.1893","0.0005","5.2408","0.0002","90","","90","","120","","789.54","0.05","120","2","120","2","","","","","","","","4","P 63 m c","P 6c -2c","186","Manganese hydroxide vanadate divanadate","Hexamanganese manganese trihydroxide dihydrogen/hydrogenvanadate divanadate","","- H4.2 Mn6.75 O18.845 V4 -","- H4.2 Mn6.749 O18.847 V4 -","- H8.4 Mn13.498 O37.694 V8 -","2","0.166667","","Shvanskaya, Larisa V.; Krikunova, Polina V.; Vasilchikova, Tatyana M.; Borovikova, Elena Y.; Volkova, Olga S.; Vasiliev, Alexander N.","Crystal structure, infrared spectroscopy and thermodynamic properties of a manganese member of the ellenbergerite family","New Journal of Chemistry","2024","48","5","1952","1957","10.1039/D3NJ05142K","","","0.71073","MoKα","","0.0199","0.018","","","0.0393","0.04","","","","","","1.078","","","","has coordinates","289584","2024-02-04","12:20:57",""
"7100128","3.3306","0.0001","3.3306","0.0001","10.8919","0.0005","90","","90","","120","","104.636","0.007","220","2","220","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- N Na Sn -","- N Na Sn -","- N2 Na2 Sn2 -","2","0.166667","","Simon Clarke; Oltan Gal; Nicholas Watney; D. Webster; Simon J. Clarke","The first ternary tin (II) nitride: NaSnN","Chemical Communications","2005","","","","","10.1039/b505208d","","","","","","","","","","","","","","","","","","","","","has coordinates","277873","2022-09-15","11:31:04",""
"7102512","26.128","0.016","26.128","0.016","24.69","0.02","90","","90","","120","","14597","18","173","2","173","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C24 H54 Br2 Ni2 S2 Si2 -","- C24 H54 Br2 Ni2 S2 Si2 -","- C288 H648 Br24 Ni24 S24 Si24 -","12","1","","Sydora, Orson L; Wolczanski, Peter T; Lobkovsky, Emil B; Rumberger, Evan; Hendrickson, David N","First row wheels, [((t)Bu(3)SiS)MX](12)(M = Co, X = Cl; M = Ni, X = Br), are common amongst both simpler and more complex aggregates.","Chemical communications (Cambridge, England)","2004","","6","650","651","10.1039/b311212h","","","0.71073","MoKα","","0.2261","0.1491","","","0.3646","0.4001","","","","","","1.128","","","","has coordinates","180127","2020-10-21","18:00:00",""
"7105364","3.19868","0.00003","3.19868","0.00003","5.19278","0.00005","90","","90","","120","","46.0121","0.0008","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","?","- Ga1.77 N1.77 O0.23 Zn0.23 -","- Ga1.77 N1.77 O0.23 Zn0.23 -","","","","Yashima, Masatomo; Yamada, Hiroki; Maeda, Kazuhiko; Domen, Kazunari","Experimental visualization of covalent bonds and structural disorder in a gallium zinc oxynitride photocatalyst (Ga(1-x)Zn(x))(N(1-x)O(x)): origin of visible light absorption.","Chemical communications (Cambridge, England)","2010","46","14","2379","2381","10.1039/b922008a","","","","","","","","","","","","","","","","","","","","","has coordinates","180157","2020-10-21","18:00:00",""
"7110615","13.4643","0.0011","13.4643","0.0011","12.6983","0.0009","90","","90","","120","","1993.6","0.3","150","","150","","","","","","","","see text","3","P 63 m c","P 6c -2c","186","","","","- C79 H13 N -","- C79 H13 N -","- C158 H26 N2 -","2","0.166667","","Marc Veen, E.; Feringa, Ben L.; Postma, Peter M.; Jonkman, Harry T.; Spek, Anthony L.","Solid state organisation of C60 by inclusion crystallisation with triptycenes†","Chemical Communications","1999","","17","1709","","10.1039/a904457d","","","0.71073","MoKα","","0.108","0.0861","","","0.2438","0.2717","","","","","","1.051","","","","has coordinates","180220","2020-10-21","18:00:00",""
"7118235","11.094","","11.094","","7.301","","90","","90","","120","","778.197","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","(C O)9 Co3 Bi","","- C9 Bi Co3 O9 -","- C9 Bi Co3 O9 -","- C18 Bi2 Co6 O18 -","2","0.166667","","Martinengo, S.; Ciani, G.","Bismuth-cobalt heteronuclear carbonyl cluster compounds. Synthesis and x-ray characteritation of the neutral Bi Co3 (C O)9 and of the paramagnetic anion (Bi2 Co4 (C O)11)-","Journal of the Chemical Society. Chemical Communications (1972-)","1987","1987","","1589","1591","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7130145","19.6109","0.0012","19.6109","0.0012","31.97","0.004","90","","90","","120","","10648","1.6","296","2","296","2","","","","","","","","7","P 63 m c","P 6c -2c","186","","","","- C36 H40 Co10 Cu4 I4 N4 O31 -","- C35.9996 H39.9996 Co10 Cu4 I4 N4 O31 -","- C71.9992 H79.9992 Co20 Cu8 I8 N8 O62 -","2","0.166667","","Peng, Shuang; Li, Yan; Ge, Rui; Chen, Wen-Xin; Wang, Tian-Yu; Li, Xin-Xiong; Zheng, Shou-Tian","Designed assembly of heterometallic zeolite-like framework materials from two different supertetrahedral metal clusters","Chemical Communications","2022","","","","","10.1039/D2CC01833K","","","0.71073","MoKα","","0.0764","0.0543","","","0.1474","0.1645","","","","","","0.95","","","","has coordinates","275640","2022-05-25","21:53:43",""
"7209333","4.683","","4.683","","7.344","","90","","90","","120","","139.48","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Dy Ag Sn","","- Ag Dy Sn -","- Ag Dy Sn -","- Ag2 Dy2 Sn2 -","2","0.166667","","Sebastian, C.P.; Heymann, G.; Heying, B.; Riecken, J.F.; Huppertz, H.; Rodewald, U.C.; Hermes, W.; Schappacher, F.M.; Poettgen, R.","The high-temperature modification of Lu Ag Sn and high-pressure high-temperature experiments on Dy Ag Sn, Ho Ag Sn, and Yb Ag Sn","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2008","63","","193","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209338","4.672","","4.672","","7.317","","90","","90","","120","","138.315","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ho Ag Sn","","- Ag Ho Sn -","- Ag Ho Sn -","- Ag2 Ho2 Sn2 -","2","0.166667","","Rodewald, U.C.; Sebastian, C.P.; Poettgen, R.; Hermes, W.; Heymann, G.; Schappacher, F.M.; Heying, B.; Riecken, J.F.; Huppertz, H.","The high-temperature modification of Lu Ag Sn and high-pressure high-temperature experiments on Dy Ag Sn, Ho Ag Sn, and Yb Ag Sn","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2008","63","","193","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209347","4.635","","4.635","","7.232","","90","","90","","120","","134.551","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Lu Ag Sn","","- Ag Lu Sn -","- Ag Lu Sn -","- Ag2 Lu2 Sn2 -","2","0.166667","","Hermes, W.; Rodewald, U.C.; Poettgen, R.; Schappacher, F.M.; Huppertz, H.; Sebastian, C.P.; Heymann, G.; Heying, B.; Riecken, J.F.","The high-temperature modification of Lu Ag Sn and high-pressure high-temperature experiments on Dy Ag Sn, Ho Ag Sn, and Yb Ag Sn","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2008","63","","193","198","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209380","4.727","","4.727","","7.716","","90","","90","","120","","149.312","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Ce Au Sn","","- Au Ce Sn -","- Au Ce Sn -","- Au2 Ce2 Sn2 -","2","0.166667","","Poduska, K.M.; DiSalvo, F.J.; Mosel, B.D.; Trill, H.; Niepmann, D.; Poettgen, R.","Structure and Properties of the Stannides CeAuSn, Ce3Rh4Sn13, and Ce3Ir4Sn13","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (42,1987-)","2001","56","","1","8","","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7209416","4.4831","","4.4831","","20.557","","90","","90","","120","","357.806","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Li Au3 Sn4","","- Au3 Li Sn4 -","- Au3 Li Sn4 -","- Au6 Li2 Sn8 -","2","0.166667","","Johrendt, D.; Wu Zhi-Yun; Poettgen, R.; Hoffmann, R.D.","The stannides Li Au Sn and Li Au3 Sn4 - syntheses, structure and chemical bonding","Journal of Materials Chemistry","2002","12","","676","680","10.1039/b109381a","","","","","","","","","","","","","","","","","","","","","has coordinates","176453","2020-10-21","18:00:00",""
"7210067","7.1512","0.00005","7.1512","0.00005","11.963","0.00011","90","","90","","120","","529.82","0.007","120","0.1","120","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0118","0.0111","","","0.0282","0.0283","","","","","","1.418","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210068","7.1641","0.00017","7.1641","0.00017","12.0317","0.0003","90","","90","","120","","534.79","0.02","150","0.1","150","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0212","0.0198","","","0.0516","0.0523","","","","","","1.205","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210069","7.17619","0.00014","7.17619","0.00014","12.1229","0.0003","90","","90","","120","","540.66","0.02","200","0.1","200","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0186","0.0167","","","0.0441","0.0447","","","","","","1.259","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210070","7.18791","0.00013","7.18791","0.00013","12.229","0.0003","90","","90","","120","","547.176","0.019","250","0.1","250","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0185","0.0155","","","0.0395","0.0404","","","","","","1.257","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210071","7.19508","0.00011","7.19508","0.00011","12.2986","0.0003","90","","90","","120","","551.388","0.018","280","0.1","280","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0192","0.0161","","","0.0421","0.043","","","","","","1.195","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210072","7.20163","0.00011","7.20163","0.00011","12.3501","0.0003","90","","90","","120","","554.706","0.018","300","0.1","300","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0203","0.0169","","","0.0407","0.0416","","","","","","1.186","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210073","7.20634","0.00014","7.20634","0.00014","12.402","0.0004","90","","90","","120","","557.77","0.02","320","0.1","320","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0228","0.0187","","","0.0431","0.0443","","","","","","1.219","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210074","7.21109","0.00019","7.21109","0.00019","12.461","0.0005","90","","90","","120","","561.16","0.03","340","0.1","340","0.1","","","","","","","","4","P 63 m c","P 6c -2c","186","guanidinium iodide","","","- C H6 I N3 -","- C H6 I N3 -","- C4 H24 I4 N12 -","4","0.333333","","Szafrański, Marek; Jarek, Marcin","Origin of spontaneous polarization and reconstructive phase transition in guanidinium iodide","CrystEngComm","2013","15","23","4617","","10.1039/c3ce26979e","","","0.71073","MoKα","","0.0254","0.0206","","","0.0479","0.0493","","","","","","1.183","","","","has coordinates","180431","2020-10-21","18:00:00",""
"7210708","5.477","0.0003","5.477","0.0003","13.0083","0.0012","90","","90","","120","","337.94","0.04","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- H2 In O6 P2 Rb -","- In O6 P2 Rb -","- In2 O12 P4 Rb2 -","2","0.166667","","Wang, Xi-Jia; Zhang, Jian-Han; Song, Jun-Ling; Kong, Fang; Mao, Jiang-Gao","Syntheses, crystal structures of a series of novel alkali metal or alkaline earth metal phosphites","CrystEngComm","2013","15","13","2519","","10.1039/c3ce26885c","","","0.71073","MoKα","","0.0304","0.0304","","","0.0736","0.0736","","","","","","1.023","","","","has coordinates","180438","2020-10-21","18:00:00",""
"7211469","10.1927","0.0004","10.1927","0.0004","14.8276","0.001","90","","90","","120","","1334.07","0.12","293","2","293","2","","","","","","","","6","P 63 m c","P 6c -2c","186","","","","- C6 H18 I6 N2 O Pb -","- C6 H14 I6 N2 O Pb -","- C12 H28 I12 N4 O2 Pb2 -","2","0.166667","","Wang, Guan-E; Jiang, Xiao-Ming; Zhang, Ming-Jian; Chen, Hui-Fen; Liu, Bin-Wen; Wang, Ming-Sheng; Guo, Guo-Cong","Crystal structures and optical properties of iodoplumbates hybrids templated by in situ synthesized 1,4-diazabicyclo[2.2.2]octane derivatives","CrystEngComm","2013","15","47","10399","","10.1039/c3ce41720d","","","0.71073","MoKα","","0.0297","0.0294","","","0.0791","0.0792","","","","","","1.166","","","","has coordinates","176432","2020-10-21","18:00:00",""
"7212147","8.223","0.0011","8.223","0.0011","13.03","0.0018","90","","90","","120","","763.02","0.18","100","2","100","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C9 H20 Cl4 Fe N -","- C8.96 H20.22 Cl4 Fe N -","- C17.92 H40.44 Cl8 Fe2 N2 -","2","0.166667","","Krieger, Brenna M.; Lee, Heather Y.; Emge, Thomas J.; Wishart, James F.; Castner, Jr, Edward W","Ionic liquids and solids with paramagnetic anions.","Physical chemistry chemical physics : PCCP","2010","12","31","8919","8925","10.1039/b920652n","","","0.71073","MoKα","","0.1059","0.1026","","","0.2718","0.2759","","","","","","1.096","","","","has coordinates","180452","2020-10-21","18:00:00",""
"7221102","13.2293","","13.2293","","5.25472","","90","","90","","120","","796.442","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Mn6.867 (O H)3 (V O4)3.602 (V2 O7)0.199","","- H3 Mn6.867 O18.801 V4 -","- Mn6.868 O18.801 V4 -","- Mn13.736 O37.602 V8 -","2","0.166667","","Zhang, F.; Zavalii, P.Yu.; Whittingham, M.S.","Synthesis and characterisation of a pipe-structure manganese vanadium oxide by hydrothermal reaction","Journal of Materials Chemistry","1999","9","","3137","3140","","","","","","","","","","","","","","","","","","","","","","has coordinates","141209","2020-10-21","18:00:00",""
"7221255","4.154","","4.154","","6.739","","90","","90","","120","","100.707","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Li Be Sb","","- Be Li Sb -","- Be Li Sb -","- Be2 Li2 Sb2 -","2","0.166667","","Tiburtius, C.; Schuster, H.U.","Li Be Sb und Li Zn Bi, ternaere Verbindungen mit Wurtzitgeruest","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1978","33","","35","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7221256","4.576","","4.576","","7.377","","90","","90","","120","","133.777","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Li Zn Bi","","- Bi Zn -","- Bi Zn -","- Bi2 Zn2 -","2","0.166667","","Tiburtius, C.; Schuster, H.U.","Li Be Sb und Li Zn Bi, ternaere Verbindungen mit Wurtzitgeruest","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1978","33","","35","38","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222391","5.997","","5.997","","9.659","","90","","90","","120","","300.837","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Sr Y (Si4 N7)","","- N7 Si4 Sr Y -","- N7 Si4 Sr Y -","- N14 Si8 Sr2 Y2 -","2","0.166667","","Fang, C.M.; Li, Y.Q.; Hintzen, H.T.; de With, G.","Crystal and electronic structure of the novel nitrides M Y Si4 N7 (M= Sr, Ba) with peculiar N Si4 coordination","Journal of Materials Chemistry","2003","13","","1480","1483","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222392","6.021","","6.021","","9.803","","90","","90","","120","","307.77","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Ba Y (Si4 N7)","","- Ba N7 Si4 Y -","- Ba N7 Si4 Y -","- Ba2 N14 Si8 Y2 -","2","0.166667","","Fang, C.M.; de With, G.; Li, Y.Q.; Hintzen, H.T.","Crystal and electronic structure of the novel nitrides M Y Si4 N7 (M= Sr, Ba) with peculiar N Si4 coordination","Journal of Materials Chemistry","2003","13","","1480","1483","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222726","8.909","","8.909","","6.878","","90","","90","","120","","472.771","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","Na6 Co S4","","- Co Na6 S4 -","- Co Na6 S4 -","- Co2 Na12 S8 -","2","0.166667","","Klepp, K.O.; Bronger, W.","Na6 Co S4 - ein Thiocobaltat mit isolierten Co S4-Anionen","Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische Chemie (33,1978-41,1986)","1983","38","","12","15","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222856","4.06","","4.06","","6.66","","90","","90","","120","","95.073","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Cu Br","","- Br Cu -","- Br Cu -","- Br2 Cu2 -","2","0.166667","","Krug, J.; Sieg, L.","Die Struktur der Hochtemperatur-Modifikationen des Cu Br und Cu J","Zeitschrift fuer Naturforschung, Teil A. Physikalische Chemie, Kosmophysik (2,1947-32,1977)","1952","7","","369","371","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"7222858","4.31","","4.31","","7.09","","90","","90","","120","","114.059","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cu I -","- Cu I -","- Cu2 I2 -","2","0.166667","","Krug, J.; Sieg, L.","Die Struktur der Hochtemperatur-Modifikationen des Cu Br und Cu I","Zeitschrift fuer Naturforschung, Teil A. Physikalische Chemie, Kosmophysik (2,1947-32,1977)","1952","7","","369","371","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"7233714","11.195","0.004","11.195","0.004","7.263","0.006","90","","90","","120","","788.3","0.8","296","2","296","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B3 Ba7 Cl O13 Si -","- B3 Ba7 Cl O13 Si -","- B6 Ba14 Cl2 O26 Si2 -","2","0.166667","","Xiaoxia Lin; Fangfang Zhang; Shilie Pan; Hongwei Yu; Fangyuan Zhang; Xiaoyu Dong; Shujuan Han; Lingyun Dong; Chunyan Bai; Zheng Wang","Ba4(BO3)3(SiO4).Ba3X (X = Cl, Br): new salt-inclusion borosilicate halides as potential deep UV nonlinear optical materials","Journal of Materials Chemistry C","2014","2","","4257","4264","10.1039/C4TC00079J","","","0.71073","MoKα","","0.0261","0.0248","","","0.0644","0.065","","","","","","1.167","","","","has coordinates,has disorder","218094","2020-10-21","18:00:00",""
"7233715","11.279","0.003","11.279","0.003","7.324","0.004","90","","90","","120","","806.9","0.5","296","2","296","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- B3 Ba7 Br O13 Si -","- B3 Ba7 Br O13 Si -","- B6 Ba14 Br2 O26 Si2 -","2","0.166667","","Xiaoxia Lin; Fangfang Zhang; Shilie Pan; Hongwei Yu; Fangyuan Zhang; Xiaoyu Dong; Shujuan Han; Lingyun Dong; Chunyan Bai; Zheng Wang","Ba4(BO3)3(SiO4).Ba3X (X = Cl, Br): new salt-inclusion borosilicate halides as potential deep UV nonlinear optical materials","Journal of Materials Chemistry C","2014","2","","4257","4264","10.1039/C4TC00079J","","","0.71073","MoKα","","0.0365","0.0322","","","0.0655","0.0684","","","","","","1.103","","","","has coordinates","218095","2020-10-21","18:00:00",""
"7234258","3.081","","3.081","","5.031","","90","","90","","120","","41.359","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Aluminum Nitride","","- Al N -","- Al N -","- Al2 N2 -","2","0.166667","","Hua Cai; Peipei Liang; Rene Hubner; Shengqiang Zhou; Yanli Li; Jian Sun; Ning Xu; Jiada Wu","Composition and bandgap control of AlxGa1-xN films synthesized by plasma-assisted pulsed laser deposition","Journal of Materials Chemistry C","2015","3","","5307","5315","10.1039/C5TC00475F","","","","","","","","","","","","","","","","","","","","","has coordinates","218956","2020-10-21","18:00:00",""
"7234259","3.1972","0.0012","3.1972","0.0012","5.207","0.003","90","","90","","120","","46.1","0.04","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Gallium Nitride - Thick Layer","","- Ga N -","- Ga N -","- Ga2 N2 -","2","0.166667","","Hua Cai; Peipei Liang; Rene Hubner; Shengqiang Zhou; Yanli Li; Jian Sun; Ning Xu; Jiada Wu","Composition and bandgap control of AlxGa1-xN films synthesized by plasma-assisted pulsed laser deposition","Journal of Materials Chemistry C","2015","3","","5307","5315","10.1039/C5TC00475F","","","","","","0.0088","","","","","","","","","","","","","","","has coordinates","218956","2020-10-21","18:00:00",""
"7235037","6.9099","0.0003","6.9099","0.0003","11.9332","0.0011","90","","90","","120","","493.44","0.05","293","2","293","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- Cs H12 Mg O10 P -","- Cs H12 Mg O10 P -","- Cs2 H24 Mg2 O20 P2 -","2","0.166667","","Yuqiao Zhou; Liling Cao; Chensheng Lin; Min Luo; Tao Yan; Ning Ye; Wendan Cheng","AMgPO4.6H2O (A = Rb, Cs): strong SHG responses originated from orderly PO4 groups","Journal of Materials Chemistry C","2016","4","","9219","9226","10.1039/C6TC03295H","","","0.71073","MoKα","","0.0163","0.0154","","","0.0316","0.0319","","","","","","1.01","","","","has coordinates","227702","2020-10-21","18:00:00",""
"7236866","10.0708","0.0019","10.0708","0.0019","12.604","0.004","90","","90","","120","","1107","0.5","173","2","173","2","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C8 Ca5 Li0 Na6 O24 -","- C8 Ca4.99 Na6.01 O24.97 -","- C16 Ca9.98 Na12.02 O49.94 -","2","0.166667","","Song, Yunxia; Luo, Min; Zhao, Dan; Peng, Guang; Lin, Chensheng; Ye, Ning","Explorations of new UV nonlinear optical materials in the Na2CO3‒CaCO3system","Journal of Materials Chemistry C","2017","5","34","8758","","10.1039/C7TC02789C","","","0.71073","MoKα","","0.0918","0.0756","","","0.239","0.2479","","","","","","1.292","","","","has coordinates","236587","2020-10-21","18:00:00",""
"7237622","8.7119","0.0002","8.7119","0.0002","22.0141","0.0009","90","","90","","120","","1446.96","0.08","219.8","0.4","219.8","0.4","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C3 H15 Bi2 I9 N6 -","- C3 H17.9997 Bi2 I9 N5.9994 -","- C6 H35.9994 Bi4 I18 N11.9988 -","2","0.166667","","Szklarz, Przemysław; Gągor, Anna; Jakubas, Ryszard; Zieliński, Piotr; Piecha-Bisiorek, Anna; Cichos, Jakub; Karbowiak, Mirosław; Bator, Grażyna; Ciżman, Agnieszka","Lead-free hybrid ferroelectric material based on formamidine: [NH2CHNH2]3Bi2I9","Journal of Materials Chemistry C","2019","7","10","3003","","10.1039/C8TC06458J","","x-ray","0.71073","MoKα","","0.0406","0.034","","","0.0851","0.0877","","","","","","1.257","","","","has coordinates","237813","2020-10-21","18:00:00",""
"7243551","13.9585","0.0006","13.9585","0.0006","6.4715","0.0003","90","","90","","120","","1091.98","0.08","150","0.1","150","0.1","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C6 H18 Cl7 Cu7 S3 -","- C6 H18 Cl7 Cu7 S3 -","- C12 H36 Cl14 Cu14 S6 -","2","0.166667","","Goreshnik, Evgeny","Influence of the synthetic conditions on a formation of 1-D, 2-D and 3-D copper–chloride coordination polymers","CrystEngComm","2021","23","40","7171","7178","10.1039/D1CE01048D","","x-ray","1.54184","CuKα","","0.0276","0.0261","","","0.0671","0.0692","","","","","","1.051","","","","has coordinates","270443","2021-11-06","19:57:25",""
"7243558","13.9585","0.0006","13.9585","0.0006","6.4715","0.0003","90","","90","","120","","1091.98","0.08","150","0.1","150","0.1","","","","","","","","5","P 63 m c","P 6c -2c","186","","","","- C6 H18 Cl7 Cu7 S3 -","- C6 H18 Cl7 Cu7 S3 -","- C12 H36 Cl14 Cu14 S6 -","2","0.166667","","Sun, Tingting; Lin, Shuang-Yan; Xu, Zhikun; Li, L.","In-situ growth of Fe doped NiCo-MOF electrocatalyst from layered double hydroxide effectively enhances electrocatalytic oxygen evolution performance","CrystEngComm","2021","","","","","10.1039/D1CE01220G","","x-ray","1.54184","CuKα","","0.0276","0.0261","","","0.0671","0.0692","","","","","","1.051","","","","has coordinates","269247","2021-09-22","22:41:32",""
"7247106","5.1806","0.0002","5.1806","0.0002","12.8377","0.001","90","","90","","120","","298.39","0.03","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Al O7 P2 -","- Al O7 P2 -","- Al2 O14 P4 -","2","0.166667","","Hao, Yucheng; Zhang, Yang; Zhang, Yuying; Fu, Zixiang; Heng, Chunyang; Li, Junjie; You, Jiatian; Hu, Kunhong; Lin, Yuan; Li, Haijian","A series of novel phosphites/phosphates with deep-ultraviolet cut-off edges from 0D polar to 3D non-polar architectures","CrystEngComm","2023","25","34","4864","4872","10.1039/D3CE00464C","","","0.71073","MoKα","","0.0377","0.0356","","","0.0963","0.0983","","","","","","1.234","","","","has coordinates","286125","2023-09-05","19:44:27",""
"7248509","7.02188","0.00005","7.02188","0.00005","10.03217","0.00012","90","","90","","120","","428.383","0.007","295","","295","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- C4 H12 Br P -","- C4 H12 Br P -","- C8 H24 Br2 P2 -","2","0.166667","","Gawraczynski, Jakub; Leszczynski, Piotr J.; Cyranski, Michal Ksawery; Dobrzycki, Łukasz; Koźmiński, Wiktor; Fijalkowski, Karol J.; Grochala, Wojciech; Jaroń, Tomasz","Synthesis and structural trends in a series of simple tetraalkylphosphonium salts","CrystEngComm","2024","","","","","10.1039/D4CE00210E","powder diffraction","x-ray","1.78892","CoKα","","0.0172","0.0162","","0.0192","0.0191","","","","1.6492","","","","","","","has coordinates","291322","2024-04-22","23:07:16",""
"8100406","9.251","0.002","9.251","0.002","7.801","0.001","90","","90","","120","","578.2","0.2","293","2","293","2","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Cu8 Eu3 Sn4 -","- Cu8 Eu3 Sn4 -","- Cu16 Eu6 Sn8 -","2","0.166667","","Fornasini, Maria L.; Manfrinetti, Pietro; Mazzone, Donata","Crystal structure of trieuropium octacopper tetrastannide, Eu~3~Cu~8~Sn~4~","Zeitschrift für Kristallographie - New Crystal Structures","2003","218","3","279","280","","","","","","","","0.0257","","","0.0612","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"8103547","7.715","","7.715","","5.22","","90","","90","","120","","269.075","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Zn (Cl O4)2 (H2 O)6","","- Cl2 H12 O14 Zn -","- Cl2 O14 Zn -","- Cl2 O14 Zn -","1","0.0833333","","Ghosh, M.; Ray, S.","Twinning and disorder in zinc perchlorate hexahydrate crystaL","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979)","1977","145","","146","154","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103548","7.815","","7.815","","5.13","","90","","90","","120","","271.335","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Fe (Cl O4)2 (H2 O)6","","- Cl2 Fe H12 O14 -","- Cl2 Fe O14 -","- Cl2 Fe O14 -","1","0.0833333","","Ghosh, M.; Ray, S.","Twinning, disorder and phase transition in ferrous perchlorate hexahydrate crystals","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (145,1977-148,1979)","1981","155","","129","137","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103854","9.269","","9.269","","6.882","","90","","90","","120","","512.048","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Pr4 N S3 Cl3","","- Cl3 N Pr4 S3 -","- Cl3 N Pr4 S3 -","- Cl6 N2 Pr8 S6 -","2","0.166667","","Schleid, T.; Meyer, M.","Cystal structure of tetrapraseodymium(III) nitride trisulfide trichloride , Pr4 N S3 Cl3","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","187","187","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103908","9.373","","9.373","","7.371","","90","","90","","120","","560.808","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Na3 Sr3 (Ga P4)","","- Ga Na3 P4 Sr3 -","- Ga Na3 P4 Sr3 -","- Ga2 Na6 P8 Sr6 -","2","0.166667","","Somer, M.; von Schnering, H.G.; Carillo-Cabrera, W.; Peters, K.; Nuss, J.; Cordier, G.","Crystal structures of trisodium tristrontium tetrapnictidogallates, Na3 Sr3 Ga P4, Na3 Sr3 Ga As4 and Na3 Sr3 Ga Sb4","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","479","480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103909","9.603","","9.603","","7.53","","90","","90","","120","","601.367","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Na3 Sr3 Ga As4","","- As4 Ga Na3 Sr3 -","- As4 Ga Na3 Sr3 -","- As8 Ga2 Na6 Sr6 -","2","0.166667","","Somer, M.; Carillo-Cabrera, W.; Peters, K.; Nuss, J.; von Schnering, H.G.; Cordier, G.","Crystal structures of trisodium tristrontium tetrapnictidogallates, Na3 Sr3 Ga P4, Na3 Sr3 Ga As4 and Na3 Sr3 Ga Sb4","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","479","480","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8103912","9.399","","9.399","","7.21","","90","","90","","120","","551.606","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","Na3 Ca3 (Al As4)","","- Al As4 Ca3 Na3 -","- Al As4 Ca3 Na3 -","- Al2 As8 Ca6 Na6 -","2","0.166667","","Somer, M.; Carrillo-Cabrera, W.; von Schnering, H.G.; Peters, K.; Cordier, G.","Crystal structure of trisodium tetraarsenidoaluminate, Na3 Ca3 Al As4","Zeitschrift fuer Kristallographie (149,1979-)","1996","211","","550","550","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"8104241","9.036","","9.036","","6.96","","90","","90","","120","","492.144","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mn Na6 S4 -","- Mn Na6 S4 -","- Mn2 Na12 S8 -","2","0.166667","","Bronger, W.; Balk-Hardtdegen, H.; Muller, P.","Zusammenhaenge zwischen Struktur und magnetischen Eigenschaften von Manganverbindungen mit tetraedrisch koordinierten Mn(II)","Zeitschrift fuer Kristallographie (149,1979-)","1988","182","","47","49","","","","","","","","","","","","","","","","","","","","","","has coordinates","211196","2020-10-21","18:00:00",""
"8104257","3.985","","3.985","","12.561","","90","","90","","120","","172.747","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","Cd Br2","","- Br2 Cd -","- Br2 Cd -","- Br4 Cd2 -","2","0.166667","","Mitchell, R.S.","Single crystal x-ray study of structural polytypism in cadmium bromide","Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik, Kristallchemie (-144,1977)","1962","117","","309","318","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"9000010","5.47","","5.47","","8.92","","90","","90","","120","","231.137","","","","","","","","","","","","not given","4","P 63 m c","P 6c -2c","186","","","Swedenborgite","- Be4 Na O7 Sb -","- Be4 Na O7 Sb -","- Be8 Na2 O14 Sb2 -","2","0.166667","","Pauling, L.; Klug, H. P.; Winchell, A. N.","The crystal structure of swedenborgite, NaBe4SbO7","American Mineralogist","1935","20","","492","501","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000085","3.824","","3.824","","31.2","","90","","90","","120","","395.113","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Wurtzite-10H","- S Zn -","- S Zn -","- S10 Zn10 -","10","0.833333","","Evans, H. T.; McKnight, E. T.","New wurtzite polytypes from Joplin, Missouri","American Mineralogist","1959","44","","1210","1218","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000086","3.82","","3.82","","24.96","","90","","90","","120","","315.429","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Wurtzite-8H","- S Zn -","- S Zn -","- S8 Zn8 -","8","0.666667","","Evans, H. T.; McKnight, E. T.","New wurtzite polytypes from Joplin, Missouri","American Mineralogist","1959","44","","1210","1218","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:13:59",""
"9000563","5.153","","5.153","","8.682","","90","","90","","120","","199.651","","","","","","","","","","","","Larvik, Norway","4","P 63 m c","P 6c -2c","186","","","Kalsilite","- Al K O3.996 Si -","- Al K O3.996 Si -","- Al2 K2 O7.992 Si2 -","2","0.166667","","Dollase, W. A.; Freeborn, W. P.","The structure of KAlSiO4 with P6_3mc symmetry Note: natural sample of kalsilite was mixed with powdered KCl and heated, it tranformed to this phase","American Mineralogist","1977","62","","336","340","","","","","","","","","","","","","","","","","","","","","","has coordinates","291269","2024-04-18","16:14:00",""
"9000846","5.734","","5.734","","18.389","","90","","90","","120","","523.605","","","","","","","","","","","","","7","P 63 m c","P 6c -2c","186","","","Magnesiohogbomite-2N2S","- Al7.29 Fe2.21 H Mg0.7 O16 Ti0.5 Zn0.3 -","- Al7.29 Fe2.21 H Mg0.7 O16 Ti0.5 Zn0.3 -","- Al14.58 Fe4.42 H2 Mg1.4 O32 Ti Zn0.6 -","2","0.166667","","Gatehouse, B. M.; Grey, I. E.","The crystal structure of hogbomite-8H","American Mineralogist","1982","67","","373","380","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:31",""
"9000891","5.89","","5.89","","9.255","","90","","90","","120","","278.059","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","","Nolanite","- Al0.15 Fe1.1 H O8 Ti0.3 V3.45 -","- Al0.15 Fe1.1 H O8 Ti0.3 V3.45 -","- Al0.3 Fe2.2 H2 O16 Ti0.6 V6.9 -","2","0.166667","","Gatehouse, B. M.; Grey, I. E.; Nickel, E. H.","The crystal chemistry of nolanite, (V,Fe,Ti,Al)10O14(OH)2, from Kalgoorlie, Western Australia sample: crystal # 1","American Mineralogist","1983","68","","833","839","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:31",""
"9000892","5.89","","5.89","","9.255","","90","","90","","120","","278.059","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","","Nolanite","- Al0.1 Fe1.75 H O8 Ti0.55 V2.6 -","- Al0.1 Fe1.75 H O8 Ti0.55 V2.6 -","- Al0.2 Fe3.5 H2 O16 Ti1.1 V5.2 -","2","0.166667","","Gatehouse, B. M.; Grey, I. E.; Nickel, E. H.","The crystal chemistry of nolanite, (V,Fe,Ti,Al)10O14(OH)2, from Kalgoorlie, Western Australia sample: crystal # 2","American Mineralogist","1983","68","","833","839","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:51:31",""
"9002666","5.7","","5.7","","27.6","","90","","90","","120","","776.586","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","Hogbomite","- Al12 H Mg4 O24 Ti -","- Al12 H Mg4 O24 Ti -","- Al24 H2 Mg8 O48 Ti2 -","2","0.166667","","Hejny, C.; Armbruster, T.","Polysomatism in hogbomite: The crystal structures of 10T, 12H, 14T and 24R polysomes Note: Data represents a model, not experiment. Sample: polytype 12H","American Mineralogist","2002","87","","277","292","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:29",""
"9004178","3.2494","","3.2494","","5.2038","","90","","90","","120","","47.584","","","","293","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Kihara, K.; Donnay, G.","Anharmonic thermal vibrations in ZnO Model: 2-c, at T = 293 K","The Canadian Mineralogist","1985","23","","647","654","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004179","3.2533","","3.2533","","5.2073","","90","","90","","120","","47.73","","","","473","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Kihara, K.; Donnay, G.","Anharmonic thermal vibrations in ZnO Model: 2-c, at T = 473 K","The Canadian Mineralogist","1985","23","","647","654","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004180","3.2494","","3.2494","","5.2038","","90","","90","","120","","47.584","","","","293","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Kihara, K.; Donnay, G.","Anharmonic thermal vibrations in ZnO Model: 3-c, at T = 293 K","The Canadian Mineralogist","1985","23","","647","654","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004181","3.2533","","3.2533","","5.2073","","90","","90","","120","","47.73","","","","473","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Kihara, K.; Donnay, G.","Anharmonic thermal vibrations in ZnO Model: 3-c, at T = 473 K","The Canadian Mineralogist","1985","23","","647","654","","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:41",""
"9004615","5.4317","","5.4317","","8.8571","","90","","90","","120","","226.305","","","","","","","","","","","","","5","P 63 m c","P 6c -2c","186","","","Swedenborgite","- Be4 Ca0.04 Na0.89 O7 Sb -","- Be4 Ca0.04 Na0.89 O7 Sb -","- Be8 Ca0.08 Na1.78 O14 Sb2 -","2","0.166667","","Huminicki, D. M. C.; Hawthorne, F. C.","Refinement of the crystal structure of swedenborgite","The Canadian Mineralogist","2001","39","","153","158","10.2113/gscanmin.39.1.153","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9004664","5.9889","","5.9889","","9.353","","90","","90","","120","","290.52","","","","","","","","","","","","Garpenberg Norra mine, Dalarna, Sweden","7","P 63 m c","P 6c -2c","186","","","Rinmanite","- Fe1.77 H Mg1.26 Mn0.16 O8 Sb Zn0.81 -","- Fe1.77 H Mg1.26 Mn0.16 O8 Sb Zn0.81 -","- Fe3.54 H2 Mg2.52 Mn0.32 O16 Sb2 Zn1.62 -","2","0.166667","","Holtstam, D.; Gatedal, K.; Soderberg, K.; Norrestam, R.","Rinmanite, Zn2Sb2Mg2Fe4O14(OH)2, a new mineral species with a nolanite-type structure from the Garpenberg Norra mine, Dalarna, Sweden","The Canadian Mineralogist","2001","39","","1675","1683","10.2113/gscanmin.39.6.1675","","","","","","","","","","","","","","","","","","","","","has coordinates","291351","2024-04-25","15:50:42",""
"9005508","12.773","","12.773","","5.051","","90","","90","","120","","713.664","","","","","","","","","","","","Tsumeb, Namibia","6","P 63 m c","P 6c -2c","186","","","Ekatite","- As2.268 Fe5.07 H9.492 O15.246 Si0.246 Zn0.9 -","- As2.268 Fe5.07 H9.492 O15.246 Si0.246 Zn0.9 -","- As4.536 Fe10.14 H18.984 O30.492 Si0.492 Zn1.8 -","2","0.166667","","Keller, P.","Ekatite, (Fe3+,Fe2+,Zn)12(OH)6[AsO3]6[AsO3,HOSiO3]2, a new mineral from Tsumeb, Namibia, and its crystal structure","European Journal of Mineralogy","2001","13","","769","777","10.1127/0935-1221/2001/0013-0769","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:53:48",""
"9005562","5.712","","5.712","","18.317","","90","","90","","120","","517.561","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","","Ferrohogbomite-2N2S","- Al7 Fe2.6 H Mg O16 Ti0.4 -","- Al7 Fe2.6 H Mg O16 Ti0.4 -","- Al14 Fe5.2 H2 Mg2 O32 Ti0.8 -","2","0.166667","","Hejny, C.; Gnos, E.; Grobety, B.; Armbruster, T.","Crystal chemistry of the polysome ferrohogbomite-2N2S, a long-known but newly defined mineral species","European Journal of Mineralogy","2002","14","","957","967","10.1127/0935-1221/2002/0014-0957","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:14",""
"9007714","5.781","","5.781","","10.06","","90","","90","","120","","291.162","","","","","","","","","","","","Kamioka mine, Gifu Prefecture, Japan","3","P 63 m c","P 6c -2c","186","","","Kamiokite","- Fe2 Mo3 O8 -","- Fe2 Mo3 O8 -","- Fe4 Mo6 O16 -","2","0.166667","","Kanazawa, Y.; Sasaki, A.","Structure of kamiokite Note: anisoB's taken from ICSD","Acta Crystallographica, Section C","1986","42","","9","11","10.1107/S0108270186097500","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9007906","3.982","","3.982","","6.445","","90","","90","","120","","88.503","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Rambergite","- Fe0.05 Mn0.95 S -","- Fe0.05 Mn0.95 S -","- Fe0.1 Mn1.9 S2 -","2","0.166667","","Eriksson, L.; Kalinowski, M. P.","Mn1-xFexS, x=0.05, an example of an anti-wurtzite structure","Acta Crystallographica, Section E","2001","57","","i92","i93","10.1107/S1600536801016051","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:04",""
"9008031","7.71","","7.71","","5.42","","90","","90","","120","","279.022","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Cl H6 Li O7 -","- Cl H6 Li O7 -","- Cl2 H12 Li2 O14 -","2","0.166667","","West, C. D.","Crystal structures of some hydrated compounds","Zeitschrift fur Kristallographie","1934","88","","198","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9008032","7.45","","7.45","","5.45","","90","","90","","120","","261.963","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- H6 I Li O3 -","- H6 I Li O3 -","- H12 I2 Li2 O6 -","2","0.166667","","West, C. D.","Crystal structures of some hydrated compounds","Zeitschrift fur Kristallographie","1934","88","","198","204","","","","","","","","","","","","","","","","","","","","","","has coordinates","287555","2023-11-12","10:38:27",""
"9008263","5.05","","5.05","","12.85","","90","","90","","120","","283.803","","","","","","","","","","","","Oldoinyo Lengai, Tanzania","5","P 63 m c","P 6c -2c","186","","","Nyerereite","- C2 Ca K0.36 Na1.64 O6 -","- C2 Ca K0.36 Na1.64 O6 -","- C4 Ca2 K0.72 Na3.28 O12 -","2","0.166667","","McKie, D.; Frankis, E. J.","Nyerereite: A new volcanic carbonate mineral from Oldoinyo Lengai, Tanzania Note: high-temperature polymorph with an structure that has been inferred","Zeitschrift fur Kristallographie","1977","145","","73","95","","","","","","","","","","","","","","","","","","","","","","has coordinates","291455","2024-05-02","11:21:05",""
"9008569","2.456","","2.456","","6.696","","90","","90","","120","","34.979","","","","","","","","","","","","","1","P 63 m c","P 6c -2c","186","Graphite","","Graphite","- C -","- C -","- C4 -","4","0.333333","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York","Crystal Structures","1963","1","","7","83","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:55:59",""
"9008859","4.58","","4.58","","7.494","","90","","90","","120","","136.137","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Iodargyrite","- Ag I -","- Ag I -","- Ag2 I2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008860","3.111","","3.111","","4.978","","90","","90","","120","","41.724","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Al N -","- Al N -","- Al2 N2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008861","2.698","","2.698","","4.38","","90","","90","","120","","27.611","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be O -","- Be2 O2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008862","4.1348","","4.1348","","6.749","","90","","90","","120","","99.926","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Greenockite","- Cd S -","- Cd S -","- Cd2 S2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008863","4.3","","4.3","","7.02","","90","","90","","120","","112.41","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Cadmoselite","- Cd Se -","- Cd Se -","- Cd2 Se2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008864","4.06","","4.06","","6.66","","90","","90","","120","","95.073","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Br Cu -","- Br Cu -","- Br2 Cu2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008865","3.91","","3.91","","6.42","","90","","90","","120","","85","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cl Cu -","- Cl Cu -","- Cl2 Cu2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008866","2.893","","2.893","","4.614","","90","","90","","120","","33.443","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cu H -","- Cu H -","- Cu2 H2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008867","4.31","","4.31","","7.09","","90","","90","","120","","114.059","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cu I -","- Cu I -","- Cu2 I2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008868","3.18","","3.18","","5.166","","90","","90","","120","","45.242","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ga N -","- Ga N -","- Ga2 N2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008869","3.533","","3.533","","5.693","","90","","90","","120","","61.54","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- In N -","- In N -","- In2 N2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008870","4.52","","4.52","","7.33","","90","","90","","120","","129.691","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mg Te -","- Mg Te -","- Mg2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008871","3.976","","3.976","","6.432","","90","","90","","120","","88.058","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Rambergite","- Mn S -","- Mn S -","- Mn2 S2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008872","4.12","","4.12","","6.72","","90","","90","","120","","98.786","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mn Se -","- Mn Se -","- Mn2 Se2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008873","4.087","","4.087","","6.701","","90","","90","","120","","96.935","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mn Te -","- Mn Te -","- Mn2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008874","3.017","","3.017","","5.58","","90","","90","","120","","43.986","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- N Nb -","- N Nb -","- N2 Nb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008875","3.076","","3.076","","5.048","","90","","90","","120","","41.364","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Moissanite","- C Si -","- C Si -","- C2 Si2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008876","3.05","","3.05","","4.94","","90","","90","","120","","39.798","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- N Ta -","- N Ta -","- N2 Ta2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008877","3.2495","","3.2495","","5.2069","","90","","90","","120","","47.615","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008878","3.811","","3.811","","6.234","","90","","90","","120","","78.411","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008879","3.98","","3.98","","6.53","","90","","90","","120","","89.58","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Se Zn -","- Se Zn -","- Se2 Zn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008880","4.27","","4.27","","6.99","","90","","90","","120","","110.373","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Te Zn -","- Te Zn -","- Te2 Zn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: wurtzite structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008883","4.314","","4.314","","5.512","","90","","90","","120","","88.838","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Yuanjiangite","- Au Sn -","- Au Sn -","- Au2 Sn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008884","3.367","","3.367","","5.16","","90","","90","","120","","50.66","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Jaipurite","- Co S -","- Co S -","- Co2 S2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008885","3.866","","3.866","","5.188","","90","","90","","120","","67.151","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Co Sb -","- Co Sb -","- Co2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008886","3.6294","","3.6294","","5.3006","","90","","90","","120","","60.468","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Freboldite","- Co Se -","- Co Se -","- Co2 Se2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008887","3.886","","3.886","","5.36","","90","","90","","120","","70.097","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Co Te -","- Co Te -","- Co2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008888","3.448","","3.448","","5.754","","90","","90","","120","","59.243","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cr S -","- Cr S -","- Cr2 S2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008889","4.108","","4.108","","5.44","","90","","90","","120","","79.504","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cr Sb -","- Cr Sb -","- Cr2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008890","3.684","","3.684","","6.019","","90","","90","","120","","70.745","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cr Se -","- Cr Se -","- Cr2 Se2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008891","3.981","","3.981","","6.211","","90","","90","","120","","85.246","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cr Te -","- Cr Te -","- Cr2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008892","4.19","","4.19","","5.086","","90","","90","","120","","77.328","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Sorosite","- Cu Sn -","- Cu Sn -","- Cu2 Sn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008893","3.43","","3.43","","5.68","","90","","90","","120","","57.872","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Fe S -","- Fe S -","- Fe2 S2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008894","4.06","","4.06","","5.13","","90","","90","","120","","73.232","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Fe Sb -","- Fe Sb -","- Fe2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008895","3.637","","3.637","","5.958","","90","","90","","120","","68.252","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Achavalite","- Fe Se -","- Fe Se -","- Fe2 Se2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008896","3.8","","3.8","","5.651","","90","","90","","120","","70.668","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Fe Te -","- Fe Te -","- Fe2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008897","3.939","","3.939","","5.386","","90","","90","","120","","72.372","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ir Te -","- Ir Te -","- Ir2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008898","3.71","","3.71","","5.691","","90","","90","","120","","67.837","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- As Mn -","- As Mn -","- As2 Mn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008899","4.3","","4.3","","6.12","","90","","90","","120","","97.998","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Bi Mn -","- Bi Mn -","- Bi2 Mn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008900","4.12","","4.12","","5.784","","90","","90","","120","","85.026","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mn Sb -","- Mn Sb -","- Mn2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008901","4.1429","","4.1429","","6.7031","","90","","90","","120","","99.636","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Mn Te -","- Mn Te -","- Mn2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008902","3.602","","3.602","","5.009","","90","","90","","120","","56.282","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Nickeline","- As Ni -","- As Ni -","- As2 Ni2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008903","3.94","","3.94","","5.14","","90","","90","","120","","69.101","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Breithauptite","- Ni Sb -","- Ni Sb -","- Ni2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008904","3.6613","","3.6613","","5.3562","","90","","90","","120","","62.181","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Sederholmite","- Ni Se -","- Ni Se -","- Ni2 Se2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008905","4.048","","4.048","","5.123","","90","","90","","120","","72.7","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ni Sn -","- Ni Sn -","- Ni2 Sn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008906","3.957","","3.957","","5.354","","90","","90","","120","","72.601","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Imgreite","- Ni Te -","- Ni Te -","- Ni2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008907","4.07","","4.07","","5.582","","90","","90","","120","","80.077","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Sudburyite","- Pd Sb -","- Pd Sb -","- Pd2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008908","4.378","","4.378","","5.627","","90","","90","","120","","93.403","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Pd Sn -","- Pd Sn -","- Pd2 Sn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008909","4.1521","","4.1521","","5.6719","","90","","90","","120","","84.683","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Kotulskite","- Pd Te -","- Pd Te -","- Pd2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008910","3.358","","3.358","","4.058","","90","","90","","120","","39.628","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- B Pt -","- B Pt -","- B2 Pt2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008911","4.315","","4.315","","5.49","","90","","90","","120","","88.525","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Bi Pt -","- Bi Pt -","- Bi2 Pt2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008912","4.13","","4.13","","5.472","","90","","90","","120","","80.831","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Stumpflite","- Pt Sb -","- Pt Sb -","- Pt2 Sb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008913","4.103","","4.103","","5.428","","90","","90","","120","","79.136","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Niggliite","- Pt Sn -","- Pt Sn -","- Pt2 Sn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008914","4.094","","4.094","","5.663","","90","","90","","120","","82.2","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Bi Rh -","- Bi Rh -","- Bi2 Rh2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008915","4.34","","4.34","","5.555","","90","","90","","120","","90.614","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Rh Sn -","- Rh Sn -","- Rh2 Sn2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:00",""
"9008916","3.99","","3.99","","5.66","","90","","90","","120","","78.036","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Rh Te -","- Rh Te -","- Rh2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:01",""
"9008917","4.122","","4.122","","6.735","","90","","90","","120","","99.102","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Sc Te -","- Sc Te -","- Sc2 Te2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:02",""
"9008918","3.3","","3.3","","6.44","","90","","90","","120","","60.736","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- S Ti -","- S Ti -","- S2 Ti2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:16",""
"9008919","3.559","","3.559","","6.22","","90","","90","","120","","68.23","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Se Ti -","- Se Ti -","- Se2 Ti2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:19",""
"9008920","3.834","","3.834","","6.39","","90","","90","","120","","81.346","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Te Ti -","- Te Ti -","- Te2 Ti2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:32",""
"9008921","3.18","","3.18","","6.22","","90","","90","","120","","54.472","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- P V -","- P V -","- P2 V2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:56:43",""
"9008922","3.36","","3.36","","5.813","","90","","90","","120","","56.834","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- S V -","- S V -","- S2 V2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:57:16",""
"9008923","3.58","","3.58","","5.977","","90","","90","","120","","66.341","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Se V -","- Se V -","- Se2 V2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:57:58",""
"9008924","3.942","","3.942","","6.126","","90","","90","","120","","82.441","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Te V -","- Te V -","- Te2 V2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:58:21",""
"9008925","3.953","","3.953","","6.647","","90","","90","","120","","89.952","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Te Zr -","- Te Zr -","- Te2 Zr2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York Note: ideal nickel arsenide structure","Crystal Structures","1963","1","","85","237","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","07:58:42",""
"9009138","4.24","","4.24","","13.67","","90","","90","","120","","212.829","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Cd I2 -","- Cd I2 -","- Cd2 I4 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York","Crystal Structures","1963","1","","239","444","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30",""
"9009139","3.66","","3.66","","10.27","","90","","90","","120","","119.142","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","","- Cd Cl H O -","- Cd Cl H O -","- Cd2 Cl2 H2 O2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York","Crystal Structures","1963","1","","239","444","","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:47",""
"9009140","4.557","","4.557","","13.958","","90","","90","","120","","251.022","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- I2 Pb -","- I2 Pb -","- I4 Pb2 -","2","0.166667","","Wyckoff, R. W. G.","Second edition. Interscience Publishers, New York, New York","Crystal Structures","1963","1","","239","444","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30",""
"9009239","3.4456","","3.4456","","5.405","","90","","90","","120","","55.572","","","","77","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ni S -","- Ni S -","- Ni2 S2 -","2","0.166667","","Trahan, J.; Goodrich, R. G.; Watkins, S. F.","X-ray diffraction measurements on metallic and semiconducting hexagonal NiS Note: T = 77 K","Physical Review B","1970","2","","2859","2863","10.1103/PhysRevB.2.2859","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30",""
"9009303","5.6867","","5.6867","","18.337","","90","","90","","120","","513.546","","","","","","","","","","","","Miriella Village, Ratnapura, Sri Lanka","4","P 63 m c","P 6c -2c","186","","","Magnesiotaaffeite-2N2S","- Al8 Be Mg3 O16 -","- Al8 Be Mg3 O16 -","- Al16 Be2 Mg6 O32 -","2","0.166667","","Nuber, B.; Schmetzer, K.","Crystal structure of ternary Be-Mg-Al oxides: taaffeite, BeMg3Al8O16, and musgravite, BeMg2Al6O12 Note: formerly known as taaffeite-8H","Neues Jahrbuch fur Mineralogie, Monatshefte","1983","1983","","393","402","","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:30",""
"9009728","5.3","","5.3","","8.65","","90","","90","","120","","210.426","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","Kalsilite","- Al K O4 Si -","- Al K O4.00002 Si -","- Al2 K2 O8.00004 Si2 -","2","0.166667","","Kawahara, A.; Andou, Y.; Marumo, F.; Okuno, M.","The crystal structure of high temperature form of kalsilite (KAlSiO4) at 950 C Note: B(1,2)'s corrected to obey symmetry restrictions Note: Synthetic sample Note: x(O1) adjusted to match reported bond lengths","Mineralogical Journal","1987","13","","260","270","10.2465/minerj.13.260","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009861","9.98","","9.98","","7.64","","90","","90","","120","","658.999","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Hg K6 S4 -","- Hg K6 S4 -","- Hg2 K12 S8 -","2","0.166667","","Sommer, H.; Hoppe, R.; Jansen, M.","Das erste thiomercurat(II) mit inselstruktur: K6(HgS4)","Die Naturwissenschaften","1976","63","","194","195","10.1007/BF00624223","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:32",""
"9009951","10.5313","","10.5313","","6.4829","","90","","90","","120","","622.679","","","","","","","","","","","","Khibiny Massif, Kola Peninsula, Russia","11","P 63 m c","P 6c -2c","186","","","Burbankite","- C5 Ba0.318 Ca0.834 Ce0.222 La0.114 Na2.184 Nd0.048 O15 Pr0.018 Sr1.899 Y0.03 -","- C5 Ba0.318 Ca0.834 Ce0.222 La0.114 Na2.184 Nd0.048 O15 Pr0.018 Sr1.899 Y0.03 -","- C10 Ba0.636 Ca1.668 Ce0.444 La0.228 Na4.368 Nd0.096 O30 Pr0.036 Sr3.798 Y0.06 -","2","0.166667","","Belovitskaya Yu, V.; Pekov, I. V.; Kabalov Yu, K.","Refinement of the crystal structures of low-rare-earth and ""typical"" burbankites by the Rietveld method Sample: B-108 Note: x02 adjusted to satisfy symmetry constraints","Crystallography Reports","2000","45","","26","29","10.1134/1.171131","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:08",""
"9009952","10.5263","","10.5263","","6.5392","","90","","90","","120","","627.49","","","","","","","","","","","","Khibiny Massif, Kola Peninsula, Russia","9","P 63 m c","P 6c -2c","186","","","Burbankite","- C5 Ba0.378 Ca1.131 Ce0.018 La0.051 Na1.86 O15 Sr2.151 Y0.018 -","- C5 Ba0.378 Ca1.131 Ce0.018 La0.051 Na1.86 O15 Sr2.151 Y0.018 -","- C10 Ba0.756 Ca2.262 Ce0.036 La0.102 Na3.72 O30 Sr4.302 Y0.036 -","2","0.166667","","Belovitskaya Yu, V.; Pekov, I. V.; Kabalov Yu, K.","Refinement of the crystal structures of low-rare-earth and ""typical"" burbankites by the Rietveld method Sample: B-104","Crystallography Reports","2000","45","","26","29","10.1134/1.171131","","","","","","","","","","","","","","","","","","","","","has coordinates","283960","2023-05-23","08:42:09",""
"9009987","5.575","","5.575","","8.761","","90","","90","","120","","235.816","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Akdalaite","- Al10 H2 O16 -","- Al10 O16 -","- Al10 O16 -","1","0.0833333","","Yamaguchi, G.; Okumiya, M.; Ono, S.","Refinement of the structure of tohdite 5Al2O3*H2O","Bulletin of the Chemical Society of Japan","1969","42","","2247","2249","10.1246/bcsj.42.2247","","","","","","","","","","","","","","","","","","","","","has coordinates","291735","2024-05-06","08:06:33",""
"9010158","3.081","","3.081","","15.1248","","90","","90","","120","","124.338","","","","","","","","","","","","150 km NW from Izmir, Turkey","2","P 63 m c","P 6c -2c","186","","","Moissanite","- C Si -","- C Si -","- C6 Si6 -","6","0.5","","Capitani, G. C.; Di Pierro, S.; Tempesta, G.","The 6H-SiC structure model: Further refinement from SCXRD data from a terrestrial moissanite","American Mineralogist","2007","92","","403","407","10.2138/am.2007.2346","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010518","3.881","","3.881","","6.315","","90","","90","","120","","82.374","","","","","","","","","","","","Llallagua, Bolivia","4","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- Fe0.25 Mn0.25 S Zn0.5 -","- Fe0.25 Mn0.25 S Zn0.5 -","- Fe0.5 Mn0.5 S2 Zn -","2","0.166667","","Mloszewski, M. J.; Saha, A. K.; Nuffield, E. W.","Manganoan ferroan wurtzite from Llallagua, Bolivia (II)","The Canadian Mineralogist","1957","6","","136","139","","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010609","7.3742","","7.3742","","11.9598","","90","","90","","120","","563.228","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- O8 Si Sn6 -","- O8 Si Sn6 -","- O16 Si2 Sn12 -","2","0.166667","","Locock, A. J.; Ramik, R. A.; Back, M. E.","The structures of two novel Sn2+ oxysalts found with romarchite and hydroromarchite as corrosion products of pewter artifacts","The Canadian Mineralogist","2006","44","","1457","1467","10.2113/gscanmin.44.6.1457","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010611","7.5238","","7.5238","","12.39","","90","","90","","120","","607.402","","","","","","","","","","","","Capillitas, Catamarca, Argentina","4","P 63 m c","P 6c -2c","186","","","Catamarcaite","- Cu6 Ge S8 W -","- Cu6 Ge S8 W -","- Cu12 Ge2 S16 W2 -","2","0.166667","","Putz, H.; Paar, W. H.; Topa, D.; Makovicky, E.; Roberts, A. C.","Catamarcaite, Cu6GeWS8, a new germanium sulfide mineral species from Capillitas, Catamarca, Argentina: Description, paragenesis and crystal structure Locality: Capillitas, Catamarca, Argentina","The Canadian Mineralogist","2006","44","","1481","1497","10.2113/gscanmin.44.6.1481","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9010636","5.6461","","5.6461","","9.2322","","90","","90","","120","","254.878","","","","","","","","","","","","La Fossa Crater, Vulcano Island, Aeolian Archipelago, Sicily, Italy","3","P 63 m c","P 6c -2c","186","","","Demartinite","- F6 K2 Si -","- F6 K2 Si -","- F12 K4 Si2 -","2","0.166667","","Gramaccioli, C. M.; Campostrini, I.","Demartinite, a new polymorph of K2SiF6 from La Fossa Crater, Vulcano, Aeolian Islands, Italy Locality: La Fossa Crater, Vulcano Island, Aeolian Archipelago, Sicily, Italy","The Canadian Mineralogist","2007","45","","1275","1280","10.2113/gscanmin.45.5.1275","","","","","","","","","","","","","","","","","","","","","has coordinates","291792","2024-05-09","08:53:45",""
"9011571","5.928","","5.928","","9.126","","90","","90","","120","","277.733","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Ferrihydrite","- Fe4.93 H O8 -","- Fe4.93 H O8 -","- Fe9.86 H2 O16 -","2","0.166667","","Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B.","The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd6","Science","2007","316","","1726","1729","10.1126/science.1142525","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011572","5.953","","5.953","","9.096","","90","","90","","120","","279.16","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Ferrihydrite","- Fe4.87 H O8 -","- Fe4.87 H O8 -","- Fe9.74 H2 O16 -","2","0.166667","","Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B.","The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd3","Science","2007","316","","1726","1729","10.1126/science.1142525","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011573","5.958","","5.958","","8.965","","90","","90","","120","","275.602","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Ferrihydrite","- Fe4.75 H O8 -","- Fe4.78 O8 -","- Fe9.56 O16 -","2","0.166667","","Michel, F. M.; Ehm, L.; Antao, S. M.; Lee, P. L.; Chupas, P. J.; Liu, G.; Strongin, D. R.; Schoonen, M. A. A.; Phillips, B. L.; Parise, J. B.","The structure of ferrihydrite, a nanocrystalline material Sample: Fhyd2","Science","2007","316","","1726","1729","10.1126/science.1142525","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011657","3.11","","3.11","","4.98","","90","","90","","120","","41.714","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Al N -","- Al N -","- Al2 N2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011658","3.19","","3.19","","5.189","","90","","90","","120","","45.729","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- Ga N -","- Ga N -","- Ga2 N2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011659","2.698","","2.698","","4.38","","90","","90","","120","","27.611","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be O -","- Be2 O2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011660","2.536","","2.536","","4.199","","90","","90","","120","","23.387","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","","- B N -","- B N -","- B2 N2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011661","3.076","","3.076","","5.048","","90","","90","","120","","41.364","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Moissanite","- C Si -","- C Si -","- C2 Si2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011662","3.249","","3.249","","5.207","","90","","90","","120","","47.601","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Zincite","- O Zn -","- O Zn -","- O2 Zn2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011663","4.137","","4.137","","6.7144","","90","","90","","120","","99.52","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Greenockite","- Cd S -","- Cd S -","- Cd2 S2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011664","4.2985","","4.2985","","7.0152","","90","","90","","120","","112.255","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Cadmoselite","- Cd Se -","- Cd Se -","- Cd2 Se2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011665","3.811","","3.811","","6.234","","90","","90","","120","","78.411","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Wurtzite","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Xu, Y. N.; Ching, W. Y.","Electronic, optical, and structural properties of some wurtzite crystals Note: 2H polytype","Physical Review B","1993","48","","4335","4351","10.1103/PhysRevB.48.4335","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011694","4.599","","4.599","","7.524","","90","","90","","120","","137.818","","","","","","","","0","","","","","2","P 63 m c","P 6c -2c","186","","","Iodargyrite","- Ag I -","- Ag I -","- Ag2 I2 -","2","0.166667","","Hull, S.; Keen, D. A.","Pressure-induced phase transitions in AgCl, AgBr, and AgI Sample: P = 0.0 GPa, Phase II","Physical Review B","1999","59","","750","761","10.1103/PhysRevB.59.750","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9011813","5.276","","5.276","","13.474","","90","","90","","120","","324.816","","","","","","","","","","","","Synthetic","5","P 63 m c","P 6c -2c","186","","","","- C2 H Na O7 Pb2 -","- C2 H Na O7 Pb2 -","- C4 H2 Na2 O14 Pb4 -","2","0.166667","","Krivovichev, S. V.; Burns, P. C.","Crystal chemistry of basic lead carbonates. III. Crystal structures of Pb3O2(CO3) and NaPb2(OH)(CO3)2","Mineralogical Magazine","2000","64","","1077","1087","10.1180/002646100549896","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:49",""
"9011948","5.284","","5.284","","12.78","","90","","90","","120","","309.02","","","","","","","","","","","","","9","P 63 m c","P 6c -2c","186","","","Ewaldite","- C Ba Ca0.48 Ce0.2 K0.11 Na0.15 O3 Sr0.03 U0.02 -","- C Ba Ca0.48 Ce0.2 K0.11 Na0.15 O3 Sr0.03 U0.02 -","- C2 Ba2 Ca0.96 Ce0.4 K0.22 Na0.3 O6 Sr0.06 U0.04 -","2","0.166667","","Donnay, G.; Preston, H.","Ewaldite, a new barium calcium carbonate II. Its crystal structure Note: unlocated carbonate group","Tschermaks Mineralogische und Petrographische Mitteilungen","1971","15","","201","212","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:45",""
"9012646","10.4974","","10.4974","","6.4309","","90","","90","","120","","613.714","","","","","","","","","","","","Vuoriyarvi, North Kareliya","9","P 63 m c","P 6c -2c","186","","","Calcioburbankite","- C5 Ba0.501 Ca1.437 Ce0.438 La0.243 Na2.667 Nd0.099 O15 Sr0.549 -","- C5 Ba0.501 Ca1.437 Ce0.438 La0.243 Na2.667 Nd0.099 O15 Sr0.549 -","- C10 Ba1.002 Ca2.874 Ce0.876 La0.486 Na5.334 Nd0.198 O30 Sr1.098 -","2","0.166667","","Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Kabalov, Y. K.; Subbotin, V. V.","Crystal structure of calcioburbankite and the characteristic features of the burbankite structure type","Crystallography Reports","2001","46","","927","931","10.1134/1.1420820","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012648","10.579","","10.579","","6.5446","","90","","90","","120","","634.312","","","","","","","","","","","","Khibiny massif, Kola Peninsula, Russia","10","P 63 m c","P 6c -2c","186","","","Khanneshite","- C5 Ba1.08 Ca0.87 Ce0.48 La0.18 Na2.58 Nd0.15 O15 Pr0.03 Sr0.63 -","- C5 Ba1.08 Ca0.87 Ce0.48 La0.18 Na2.58 Nd0.15 O15 Pr0.03 Sr0.63 -","- C10 Ba2.16 Ca1.74 Ce0.96 La0.36 Na5.16 Nd0.3 O30 Pr0.06 Sr1.26 -","2","0.166667","","Belovitskaya, Y. V.; Pekov, I. V.; Gobechiya, E. R.; Kabalov, Y. K.; Schneider, J.","Determination of the crystal structure of khanneshite by the Rietveld method","Crystallography Reports","2002","47","","39","42","10.1134/1.1446907","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:47",""
"9012758","5.6153","","5.6153","","8.8247","","90","","90","","120","","240.978","","","","","","","","","","","","Theoretical structure","3","P 63 m c","P 6c -2c","186","","","Akdalaite","- Al5 H O8 -","- Al5 H O8 -","- Al10 H2 O16 -","2","0.166667","","Demichelis, R.; Noel, Y.; Zicovich-Wilson C M; Roetti, C.; Valenzano, L.; Dovesi, R.","Ab-initio quantum mechanical study of akdalaite (5Al2O3*H2O): Structure and vibrational spectrum,","Journal of Physics: Conference Series","2008","117","","012013","012013","10.1088/1742-6596/117/1/012013","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9012811","5.318","","5.318","","12.837","","90","","90","","120","","314.406","","","","","","","","","","","","","4","P 63 m c","P 6c -2c","186","","","Ewaldite","- C Ba Ca O6.72 -","- C Ba Ca O6.72 -","- C2 Ba2 Ca2 O13.44 -","2","0.166667","","Voloshin, A. V.; Subbotin, V. V.; Yakovenchuk, V. N.; Pakhomovsky, Y. A.; Men'shikov, Y. P.; Nadezhina, T. N.; Pushcharovsky, D. Y.","New data on the ewaldite","Zapiski Vsesoyuznogo Mineralogicheskogo Obshchestva","1992","1992","","56","66","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9012884","8.288","","8.288","","10.542","","90","","90","","120","","627.124","","","","","","","","","","","","Synthetic","1","P 63 m c","P 6c -2c","186","","","Cobalt","- Co -","- Co -","- Co46 -","46","3.83333","","Krainer, E.; Robitsch, J.","Nachweis einer neuen phase bei der funkenerosiven behandlung von kobalt","Zeitschrift fur Metallkunde","1970","61","","350","354","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013162","3.812","","3.812","","18.68999","","90","","90","","120","","235.204","","","","","","","","","","","","Thomaston Dam, Connecticut","2","P 63 m c","P 6c -2c","186","","","Wurtzite-6H","- S Zn -","- S Zn -","- S6 Zn6 -","6","0.5","","Myer, G. H.","Hydrothermal wurtzite at Thomaston Dam, Connecticut","American Mineralogist","1962","47","","977","979","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:48",""
"9013304","3.8754","","3.8754","","6.3276","","90","","90","","120","","82.301","","","","","","","","","","","","Llallagua, Bolivia","4","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- Fe0.26 Mn0.31 S Zn0.43 -","- Fe0.26 Mn0.31 S Zn0.43 -","- Fe0.52 Mn0.62 S2 Zn0.86 -","2","0.166667","","Mloszewski, M. J.; Saha, A. K.; Nuffield, E. W.","Manganoan ferroan wurtzite from Llallagua, Bolivia (II)","The Canadian Mineralogist","1957","6","","136","139","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013305","3.8227","","3.8227","","12.52","","90","","90","","120","","158.444","","","","","","","","","","","","Mont Saint-Hilaire, Quebec, Canada","2","P 63 m c","P 6c -2c","186","","","Wurtzite-4H","- S Zn -","- S Zn -","- S4 Zn4 -","4","0.333333","","Chao, G. Y.; Gault, R. A.","The occurence of two rare polytypes of wurtzite, 4H and 8H, at Mont Saint-Hilaire, Quebec","The Canadian Mineralogist","1998","36","","775","778","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013409","3.814","","3.814","","12.46","","90","","90","","120","","156.968","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Wurtzite-4H","- S Zn -","- S Zn -","- S4 Zn4 -","4","0.333333","","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",""
"9013412","3.818","","3.818","","6.26","","90","","90","","120","","79.027","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Ballentyne, D. W. G.; Roy, B.","Electroluminescence and crystal structure in the alloy system ZnS - CdS","Physica","1961","27","","337","341","10.1016/0031-8914(61)90106-9","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013420","3.777","","3.777","","6.188","","90","","90","","120","","76.45","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- S Zn -","- S Zn -","- S2 Zn2 -","2","0.166667","","Yeh, C.; Lu, Z. W.; Froyen, S.; Zunger, A.","Zinc-blende-wurtzite polytypism in semiconductors","Physical Review B","1992","46","","10086","10097","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013421","4.064","","4.064","","6.643","","90","","90","","120","","95.017","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","","- Mn0.29 Se Zn0.71 -","- Mn0.29 Se Zn0.71 -","- Mn0.58 Se2 Zn1.42 -","2","0.166667","","Yeh, C.; Lu, Z. W.; Froyen, S.; Zunger, A.","High-pressure phase transitions in Zn1-xMnxSe: A Raman scattering and photoluminescence study Note: wurtzite structure Note: synthetic","Physical Review B","1995","52","","11052","11058","10.1103/PhysRevB.52.11052","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013497","3.8353","","3.8353","","6.3008","","90","","90","","120","","80.265","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- Fe0.434 S Zn0.566 -","- Fe0.434 S Zn0.566 -","- Fe0.868 S2 Zn1.132 -","2","0.166667","","Kullerud, G.","The Fe S - Zn S system. A geological thermometer","Norsk Geologisk Tidsskrift","1953","32","","61","147","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013498","3.8357","","3.8357","","6.3002","","90","","90","","120","","80.274","","","","","","","","","","","","","3","P 63 m c","P 6c -2c","186","","","Wurtzite-2H","- Fe0.442 S Zn0.558 -","- Fe0.442 S Zn0.558 -","- Fe0.884 S2 Zn1.116 -","2","0.166667","","Kullerud, G.","The Fe S - Zn S system. A geological thermometer","Norsk Geologisk Tidsskrift","1953","32","","61","147","","","","","","","","","","","","","","","","","","","","","","has coordinates","291877","2024-05-16","06:53:49",""
"9013840","10.514","","10.514","","6.477","","90","","90","","120","","620.07","","","","","","","","","","","","Cioclovina Cave sediments, Romania","12","P 63 m c","P 6c -2c","186","","","Burbankite","- C5 Ba0.33 Ca0.99 Ce0.15 La0.06 Na2.46 Nd0.06 O15 Pr0.03 Sr1.71 Th0.09 Y0.09 -","- C10 Ba0.66 Ca1.98 Ce0.3 La0.12 Na4.92 Nd0.12 O30 Pr0.06 Sr3.42 Th0.18 Yb0.18 -","- C10 Ba0.66 Ca1.98 Ce0.3 La0.12 Na4.92 Nd0.12 O30 Pr0.06 Sr3.42 Th0.18 Yb0.18 -","","","","Onac, B. P.; Bernhardt, H. J.; Effenberger, H.","Authigenic burbankite in the Cioclovina Cave sediments (Romania)","European Journal of Mineralogy","2009","21","","507","514","10.1127/0935-1221/2009/0021-1916","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013936","10.5702","","10.5702","","6.6509","","90","","90","","120","","643.543","","","","","","","","","","","","Santa Rosa mine, near Iquique, Chile","5","P 63 m c","P 6c -2c","186","","","Sanromanite","- C5 Ca Na2 O15 Pb3 -","- C10 Ca1.99998 Na4.00002 O30 Pb6 -","- C10 Ca1.99998 Na4.00002 O30 Pb6 -","","","","Schluter, J.; Malcherek, T.; Pohl, D.","Sanromanite, from the Santa Rosa mine, Atacama desert, Chile, a new mineral of the burbankite group","Neues Jahrbuch fur Mineralogie, Abhandlungen","2007","183","","117","121","","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:32:12",""
"9013968","12.467","","12.467","","5.0437","","90","","90","","120","","678.897","","","","","","","","","","","","","6","P 63 m c","P 6c -2c","186","","","Phosphoellenbergerite","- C0.38 H6.92 As0.3 Mg6.68 O18.62 P3.32 -","- C0.38 H6.92 As0.3 Mg6.68 O18.62 P3.32 -","- C0.76 H13.84 As0.6 Mg13.36 O37.24 P6.64 -","2","0.166667","","Raade, G.; Romming, C.; Medenbach, O.","Carbonate-substituted phosphoellenbergerite from Modum, Norway: description and crystal structure","Mineralogy and Petrology","1998","62","","89","101","10.1007/BF01173764","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:50",""
"9014057","2.7178","","2.7178","","4.4078","","90","","90","","120","","28.196","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: T = 1183 K","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014106","2.786","","2.786","","4.412","","90","","90","","120","","29.657","","","","","","","","","","","","","2","P 63 m c","P 6c -2c","186","","","Akhtenskite","- Mn0.5 O -","- Mn O2 -","- Mn O2 -","","","","Kondrashev, Y. D.; Zaslavskii, A. I.","The structure of the modifications of manganese oxide","Izvestiya Akademii Nauk SSSR","1951","15","","179","186","","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014120","2.6983","","2.6983","","4.3776","","90","","90","","120","","27.602","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 1 in air","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014267","2.6776","","2.6776","","4.3454","","90","","90","","120","","26.981","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 5.0 GPa","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014346","2.6983","","2.6983","","4.3776","","90","","90","","120","","27.602","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 1 in cell","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014411","2.6983","","2.6983","","4.3776","","90","","90","","120","","27.602","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 3 in mount","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014621","5.6978","","5.6978","","18.373","","90","","90","","120","","516.565","","","","","","","","","","","","Xianghualing tin-polymetallic ore field, Hunan Province, China","7","P 63 m c","P 6c -2c","186","","","Magnesiotaaffeite-2N'2S","- Al8 Be Fe0.885 Mg1.73 O16 Sn0.063 Zn0.322 -","- Al16 Be2 Fe1.77 Mg3.46 O32 Sn0.126 Zn0.644 -","- Al16 Be2 Fe1.77 Mg3.46 O32 Sn0.126 Zn0.644 -","","","","Yang, Z.; Ding, K.; De Fourestier, J.; Mao, Q.; Li, H.","Ferrotaaffeite-2N'2S, a new mineral species, and the crystal structure of Fe2±rich magnesiotaaffeite-2N'2S from the Xianghualing tin-polymetallic ore field, Hunan Province, China","The Canadian Mineralogist","2012","50","","21","29","10.3749/canmin.50.1.21","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014809","2.714","","2.714","","4.405","","90","","90","","120","","28.099","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: T = 1073 K","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014858","2.6983","","2.6983","","4.3776","","90","","90","","120","","27.602","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 2 in air","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9014945","3.521","","3.521","","5.901","","90","","90","","120","","63.356","","","","","","","","","","","","Synthetic","3","P 63 m c","P 6c -2c","186","","","Achavalite","- Fe S0.5 Se0.5 -","- Fe2 S Se -","- Fe2 S Se -","","","","Franz, E. D.","Rontgenographische Daten der Mischphasen im System Pyrit (FeS2) - Ferroselit (FeSe2)/Pyrrhotin (FeS) - Achavalit (FeSe)","Neues Jahrbuch fur Mineralogie, Monatshefte","1972","1972","","276","280","","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015050","2.705","","2.705","","4.3927","","90","","90","","120","","27.835","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: T = 763 K","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015076","3.636","","3.636","","5.946","","90","","90","","120","","68.077","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Achavalite","- Fe Se -","- Fe2 Se2 -","- Fe2 Se2 -","","","","Franz, E. D.","Rontgenographische Daten der Mischphasen im System Pyrit (FeS2) - Ferroselit (FeSe2)/Pyrrhotin (FeS) - Achavalit (FeSe)","Neues Jahrbuch fur Mineralogie, Monatshefte","1972","1972","","276","280","","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015191","2.6983","","2.6983","","4.3776","","90","","90","","120","","27.602","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: Crystal no. 2 in cell","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015335","3.8357","","3.8357","","6.3002","","90","","90","","120","","80.274","","","","","","","","","","","","Zaklodzie, Poland","5","P 63 m c","P 6c -2c","186","","","Buseckite","- Fe0.46 Mg0.04 Mn0.16 S Zn0.32 -","- Fe0.92 Mg0.08 Mn0.32 S2 Zn0.64 -","- Fe0.92 Mg0.08 Mn0.32 S2 Zn0.64 -","","","","Ma, C.; Beckett, J. R.; Rossman, G. R.","Buseckite, (Fe,Zn,Mn)S, a new mineral from the Zaklodzie meteorite","American Mineralogist","2012","97","","1226","1233","10.2138/am.2012.4110","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015790","2.7002","","2.7002","","4.3851","","90","","90","","120","","27.689","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: T = 543 K","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015805","2.6825","","2.6825","","4.3525","","90","","90","","120","","27.124","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 4.0 GPa","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9015806","5.7105","","5.7105","","27.676","","90","","90","","120","","781.596","","","","","","","","","","","","central Sor Rondane Mountains, East Antarctica","6","P 63 m c","P 6c -2c","186","","","Magnesiohogbomite-2N4S","- Al11 Fe0.783 H Mg4.217 O24 Ti -","- Al11 Fe0.783 H Mg4.217 O24 Ti -","- Al22 Fe1.566 H2 Mg8.434 O48 Ti2 -","2","0.166667","","Shimura, T.; Akai, J.; Lazic, B.; Armbruster, T.; Shimizu, M.; Kamei, A.; Tsukada, K.; Owada, M.; Yuhara, M.","Magnesiohogbomite-2N4S: A new polysome from the central Sor Rondane Mountains, East Antarctica","American Mineralogist","2012","97","","268","280","10.2138/am.2012.3827","","","","","","","","","","","","","","","","","","","","","has coordinates","283658","2023-05-10","17:55:51",""
"9015875","12.584","","12.584","","5.101","","90","","90","","120","","699.557","","","","","","","","","","","","Lovozero","6","P 63 m c","P 6c -2c","186","","","Cancrisilite","- C0.704 H2 Al2.28 Na3.702 O15.112 Si3.72 -","- C0.704 H2 Al2.28 Na3.702 O15.112 Si3.72 -","- C1.408 H4 Al4.56 Na7.404 O30.224 Si7.44 -","2","0.166667","","Pekov, I. V.; Olysych, L. V.; Chukanov, N. V.; Zubkova, N. V.; Pushcharovsky D Yu; Van, K. V.; Giester, G.; Tillmanns, E.","Crystal chemistry of cancrinite-group minerals with an AB-type framework: A review and new data. I. Chemical and structural variations Note: Sample# u1631","The Canadian Mineralogist","2012","49","","1129","1150","10.3749/canmin.49.5.1129","","","","","","","","","","","","","","","","","","","","","has coordinates","283857","2023-05-18","09:26:09",""
"9015995","3.619","","3.619","","5.036","","90","","90","","120","","57.121","","","","","","","","","","","","Jachymov, Bohemia, Czech Republic","4","P 63 m c","P 6c -2c","186","","","Nickelite","- As Co0.01 Ni0.97 S0.02 -","- As Co0.01 Ni0.97 S0.02 -","- As2 Co0.02 Ni1.94 S0.04 -","2","0.166667","","Ondrus, P.; Veselovsky, F.; Gabasova, A.; Hlousek, J.; Srein, V.; Vavrnn, I.; Skala, R.; Sejkora, J.; Drabek, M.","Primary minerals of the Jachymov ore district Sample MP511","Journal of the Czech Geological Society","2003","48","","19","147","","","","","","","","","","","","","","","","","","","","","","has coordinates","264423","2021-04-22","17:34:04",""
"9016036","5.729","","5.729","","37.097","","90","","90","","120","","1054.45","","","","","","","","","","","","Nezilovo, Macedonia","7","P 63 m c","P 6c -2c","186","","","Zincohogbomite-2N6S","- Al14.648 Fe H Mg0.214 O32 Ti0.78 Zn6.37 -","- Al14.6475 Fe H Mg0.2142 O32 Ti0.78 Zn6.37 -","- Al29.295 Fe2 H2 Mg0.4284 O64 Ti1.56 Zn12.74 -","2","0.166667","","Armbruster, T.; Bermanec, V.; Zebec, V.; Oberhansli, R.","Titanium and iron poor zincohogbomite-16H, Zn14(Al,Fe3+,Ti,Mg)8Al24O62(OH)2, from Nezilovo, Macedonia: occurence and crystal structure of a new polysome","Schweizerische Mineralogische und Petrographische Mitteilungen","1998","78","","469","477","","","","","","","","","","","","","","","","","","","","","","has coordinates","283911","2023-05-21","08:37:46",""
"9016056","4.299","","4.299","","7.01","","90","","90","","120","","112.198","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Cadmoselite","- Cd Se -","- Cd2 Se2 -","- Cd2 Se2 -","","","","Freeman, D. K.; Mair, S. L.; Barnea, Z.","The structure and Bijvoet ratios of cadmium selenide","Acta Crystallographica, Section A","1977","33","","355","359","10.1107/S0567739477000977","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016112","2.7109","","2.7109","","4.3999","","90","","90","","120","","28.003","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: T = 963 K","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016297","2.6832","","2.6832","","4.3524","","90","","90","","120","","27.137","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 3.8 GPa","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016408","2.6928","","2.6928","","4.3705","","90","","90","","120","","27.445","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 1.1 GPa","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9016524","2.6883","","2.6883","","4.3614","","90","","90","","120","","27.297","","","","","","","","","","","","Synthetic","2","P 63 m c","P 6c -2c","186","","","Bromellite","- Be O -","- Be2 O2 -","- Be2 O2 -","","","","Hazen, R. M.; Finger, L. W.","High-pressure and high-temperature crystal chemistry of beryllium oxide Note: P = 2.2 GPa","Journal of Applied Physics","1986","59","","3728","3733","10.1063/1.336756","","","","","","","","","","","","","","","","","","","","","has coordinates","201816","2020-10-21","18:00:00",""
"9017817","13.839","","13.839","","4.496","","90","","90","","120","","745.704","","","","","","","","","","","","Luobusha ophiolite, Tibet","4","P 63 m c","P 6c -2c","186","","","Yarlongite","- C13.117 Cr11.515 Fe12.355 Ni2.867 -","- C22.2336 Cr23.0292 Fe24.7092 Ni5.7336 -","- C22.2336 Cr23.0292 Fe24.7092 Ni5.7336 -","","","","Shi, N.; Ma, Z.; Xiong, M.; Dai, M.; Bai, W.; Fang, Q.; Yan, B.; Yang, J.","The crystal structure of (Fe4Cr4Ni)9C4","Science in China","2005","48","","338","345","","","","","","","","","","","","","","","","","","","","","","has coordinates","282074","2023-03-27","08:29:24",""