# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-12-30T17:23:46+01:00
# Query:
# SELECT data.*
# FROM
#  data JOIN jaltnames
#  ON altname = journal
# WHERE
#  (status is null or status != 'retracted') and
#  (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Acta Crystallographica Section B') AND volume = 48 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
"1001691","5.3791","0.0006","5.3811","0.0009","24.58899","0.003","90","","89.93","0.01","90","","711.7","","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","Bismuth strontium copper oxide (1.9/1.8/1/5.5)","","- Bi1.916 Cu O5.482 Sr1.84 -","- Bi1.9158 Cu O5.482 Sr1.84 -","- Bi7.6632 Cu4 O21.928 Sr7.36 -","4","0.5","","Leligny, H; Durcok, S; Labbe, P; Ledesert, M; Raveau, B","X-ray investigation of the incommensurate modulated structure of Bi2.08 Sr1.84 Cu O6-d","Acta Crystallographica B (39,1983-)","1992","48","","407","418","","","","","","","0.061","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"1008498","9.317","0.004","9.72","0.004","6.685","0.003","90","","91.95","0.02","90","","605.1","","","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","Tristrontium copper platinum(IV) oxide","","- Cu O6 Pt Sr3 -","- Cu O6 Pt Sr3 -","- Cu4 O24 Pt4 Sr12 -","4","0.5","","Hodeau, J L; Tu, H Y; Bordet, P; Fournier, T; Strobel, P; Marezio, M; Chandrashekhar, G V","Structure and twinning of Sr~3~CuPtO~6~","Acta Crystallographica B (39,1983-)","1992","48","","1","11","","","","","","","0.048","","","","","","","","","","","","","","","has coordinates","130149","2020-10-21","18:00:00",""
"2100751","3.9993","0.0005","3.9993","0.0005","17.283","0.002","90","","90","","90","","276.43","0.06","","","","","","","","","","","","2","I 4/m m m","-I 4 2","","","","","- Al3 Zr -","- Al3 Zr -","- Al12 Zr4 -","4","0.125","AB0236","Ma, Y.; Rømming, C.; Lebech, B.; Gjønnes, J.; Taftø, J.","Structure refinement of Al~3~Zr using single-crystal X-ray diffraction, powder neutron diffraction and CBED","Acta Crystallographica Section B","1992","48","1","11","16","10.1107/S0108768191010467","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100752","4.0065","0.0004","4.0065","0.0004","17.284","0.003","90","","90","","90","","277.44","0.06","","","","","","","","","","","","2","I 4/m m m","-I 4 2","","","","","- Al3 Zr -","- Al3 Zr -","- Al12 Zr4 -","4","0.125","AB0236","Ma, Y.; Rømming, C.; Lebech, B.; Gjønnes, J.; Taftø, J.","Structure refinement of Al~3~Zr using single-crystal X-ray diffraction, powder neutron diffraction and CBED","Acta Crystallographica Section B","1992","48","1","11","16","10.1107/S0108768191010467","","neutron","1.0867","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100753","7.4013","0.0004","8.7563","0.0005","17.392","0.001","90","","90","","90","","1127.14","0.11","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C10 H15 N3 O4 -","- C10 H15 N3 O4 -","- C40 H60 N12 O16 -","4","1","GE0271","De Winter, H. L.; De Ranter, C. J.; Blaton, N. M.; Peeters, O. M.; Van Aerschot, A.; Herdewijn, P.","1-(2,3-Dideoxy-<i>erythro</i>-β-<small>D</small>-hexopyranosyl)cytosine: an example of the conformational and stacking properties of pyranosyl pyrimidine nucleosides. A crystallographic and computational approach","Acta Crystallographica Section B","1992","48","1","95","103","10.1107/S0108768191010546","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100754","4.293","0.005","4.84","0.01","27.35","0.09","85.3","0.3","68.2","0.1","72.6","0.1","503","2","","","","","","","","","","","","2","P -1","-P 1","2","","","","- C20 H42 -","- C20 H42 -","- C20 H42 -","1","0.5","LI0091","Nyburg, S. C.; Gerson, A. R.","Crystallography of the even <i>n</i>-alkanes: structure of C~20~H~42~","Acta Crystallographica Section B","1992","48","1","103","106","10.1107/S0108768191011059","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:32",""
"2100756","9.048","0.001","7.987","0.002","9.911","0.001","90","","92.13","0.01","90","","715.7","0.2","","","","","","","","","","","","4","I 1 2/c 1","-I 2yab","","","","","- Ba H2 I2 O7 -","- Ba H2 I2 O7 -","- Ba4 H8 I8 O28 -","4","0.5","AB0254","Kellersohn, T.; Lutz, H. D.; Vogt, T.; Delaplane, R. G.; Olovsson, I.","Structural instabilities of the trigonally coordinated water molecules in Ba(IO~3~)~2~.H~2~O and Pb(ClO~3~)~2~.H~2~O studied by X-ray and neutron diffraction at 25 and 295 K","Acta Crystallographica Section B","1992","48","2","166","172","10.1107/S0108768191013538","","neutron","1.27","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100757","9.022","0.005","7.937","0.004","9.867","0.006","90","","92.18","0.05","90","","706","0.7","","","","","","","","","","","","4","I 1 2/c 1","-I 2yab","","","","","- Ba H2 I2 O7 -","- Ba H2 I2 O8 -","- Ba4 H8 I8 O32 -","4","0.5","AB0254","Kellersohn, T.; Lutz, H. D.; Vogt, T.; Delaplane, R. G.; Olovsson, I.","Structural instabilities of the trigonally coordinated water molecules in Ba(IO~3~)~2~.H~2~O and Pb(ClO~3~)~2~.H~2~O studied by X-ray and neutron diffraction at 25 and 295 K","Acta Crystallographica Section B","1992","48","2","166","172","10.1107/S0108768191013538","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100758","8.811","0.001","7.744","0.001","9.131","0.001","90","","93.13","0.01","90","","622.1","0.1","","","","","","","","","","","","4","I 1 2/c 1","-I 2yab","","","","","- Cl2 H2 O7 Pb -","- Cl2 H2 O7 Pb -","- Cl8 H8 O28 Pb4 -","4","0.5","AB0254","Kellersohn, T.; Lutz, H. D.; Vogt, T.; Delaplane, R. G.; Olovsson, I.","Structural instabilities of the trigonally coordinated water molecules in Ba(IO~3~)~2~.H~2~O and Pb(ClO~3~)~2~.H~2~O studied by X-ray and neutron diffraction at 25 and 295 K","Acta Crystallographica Section B","1992","48","2","166","172","10.1107/S0108768191013538","","neutron","1.238","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100759","8.811","0.001","7.744","0.001","9.131","0.001","90","","93.13","0.01","90","","622.1","0.1","","","","","","","","","","","","4","I 1 2/c 1","-I 2yab","","","","","- Cl2 H2 O7 Pb -","- Cl2 H2 O7 Pb -","- Cl8 H8 O28 Pb4 -","4","0.5","AB0254","Kellersohn, T.; Lutz, H. D.; Vogt, T.; Delaplane, R. G.; Olovsson, I.","Structural instabilities of the trigonally coordinated water molecules in Ba(IO~3~)~2~.H~2~O and Pb(ClO~3~)~2~.H~2~O studied by X-ray and neutron diffraction at 25 and 295 K","Acta Crystallographica Section B","1992","48","2","166","172","10.1107/S0108768191013538","","neutron","1.238","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100760","8.755","0.001","7.697","0.001","9.13","0.001","90","","93.45","0.01","90","","614.13","0.13","","","","","","","","","","","","4","I 1 2/c 1","-I 2yab","","","","","- Cl2 H2 O7 Pb -","- Cl2 H2 O7 Pb -","- Cl8 H8 O28 Pb4 -","4","0.5","AB0254","Kellersohn, T.; Lutz, H. D.; Vogt, T.; Delaplane, R. G.; Olovsson, I.","Structural instabilities of the trigonally coordinated water molecules in Ba(IO~3~)~2~.H~2~O and Pb(ClO~3~)~2~.H~2~O studied by X-ray and neutron diffraction at 25 and 295 K","Acta Crystallographica Section B","1992","48","2","166","172","10.1107/S0108768191013538","","neutron","1.215","neutron","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100761","9.399","0.002","12.673","0.002","6.071","0.001","90","","107.13","0.01","90","","691.1","0.2","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- Cu D20 N2 O14 S2 -","- Cu D20 N2 O14 S2 -","- Cu2 D40 N4 O28 S4 -","2","0.5","AL0504","Figgis, B. N.; Khor, L.; Kucharski, E. S.; Reynolds, P. A.","Charge density around a Jahn-Teller-distorted site: (ND~4~)~2~Cu(SO~4~)~2~.6D~2~O at 85 K","Acta Crystallographica Section B","1992","48","2","144","151","10.1107/S010876819101323X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2100762","14.146","0.006","14.146","0.006","11.91","0.008","90","","90","","90","","2383","2","","","","","","","","","","","","4","I -4","","","","","","- C11 H19 Br O -","- C11 H19 Br O -","- C88 H152 Br8 O8 -","8","1","AL0506","Fallon, G. D.; Gatehouse, B. M.; Middleton, S.; Vanni, S. P.","Structure of the bromohydrin of an octahydronaphthalene derivative","Acta Crystallographica Section B","1992","48","2","227","230","10.1107/S0108768191013812","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100763","8.933","0.002","11.71","0.003","18.934","0.004","90","","90","","90","","1980.6","0.8","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","","","","","- C20 H28 Cl N S -","- C20 H28 Cl N S -","- C80 H112 Cl4 N4 S4 -","4","1","CR0350","Karle, J. M.; Karle, I. L.; Gordon, R. K.; Chiang, P. K.","Relationship of three-dimensional structure of muscarinic antagonists to antimuscarinic activity: structure of thiodeacylaprophen hydrochloride","Acta Crystallographica Section B","1992","48","2","208","213","10.1107/S0108768191013149","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100764","10.36","0.005","12.169","0.005","12.488","0.004","95.14","0.1","108.49","0.12","114.69","0.05","1310.8","1.9","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H19 N O2 -","- C15 H19 N O2 -","- C60 H76 N4 O8 -","4","2","GE0284","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Gregoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new bronchospasmolytic agents. I","Acta Crystallographica Section B","1992","48","2","178","185","10.1107/S0108768191011771","","","1.54056","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100765","10.063","0.009","19.398","0.005","8.67","0.005","90","","110.56","0.01","90","","1584.6","1.7","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H27 N O3 -","- C17 H27 N O3 -","- C68 H108 N4 O12 -","4","1","GE0284","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Gregoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new bronchospasmolytic agents. I","Acta Crystallographica Section B","1992","48","2","178","185","10.1107/S0108768191011771","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2100766","4.933","0.002","9.409","0.001","22.865","0.004","90","","94.16","0.02","90","","1058.5","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C9 H12 N4 O2 -","- C9 H12 N4 O2 -","- C36 H48 N16 O8 -","4","1","LI0113","Neidle, S.; Wilman, D. E. V.","X-ray studies on anti-tumour triazenes. Structures of 1-(4-carbamoylphenyl)-3,3-dimethyltriazene 1-oxide and 3,3-dimethyl-1-(4-nitrophenyl)triazene","Acta Crystallographica Section B","1992","48","2","213","217","10.1107/S0108768191013599","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2100767","5.966","0.001","7.681","0.001","10.483","0.001","103.29","0.01","93.08","0.01","94.61","0.01","464.71","0.11","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C8 H10 N4 O2 -","- C8 H10 N4 O2 -","- C16 H20 N8 O4 -","2","1","LI0113","Neidle, S.; Wilman, D. E. V.","X-ray studies on anti-tumour triazenes. Structures of 1-(4-carbamoylphenyl)-3,3-dimethyltriazene 1-oxide and 3,3-dimethyl-1-(4-nitrophenyl)triazene","Acta Crystallographica Section B","1992","48","2","213","217","10.1107/S0108768191013599","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100768","10.894","0.002","10.013","0.001","43.237","0.006","90","","90","","90","","4716","1","","","","","","","","","","","","6","P 21 c a","","","","","","- C5 H15 Ca Cl2 N O4 -","- C H2 Ca0.25 Cl0.25 N0.25 O0.75 -","- C16 H32 Ca4 Cl4 N4 O12 -","16","4","AL0497","Ezpeleta, J. M.; Zúñiga, F. J.; Pérez-Mato, J. M.; Paciorek, W. A.; Breczewski, T.","Structural analysis of the fourfold phase of betaine calcium chloride dihydrate at 90 K","Acta Crystallographica Section B","1992","48","3","261","269","10.1107/S0108768191013472","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100769","10.894","0.002","10.013","0.001","43.237","0.006","90","","90","","90","","4716","1","","","","","","","","","","","","6","P 21 c a","","","","","","- C5 H15 Ca Cl2 N O4 -","- C5 H14.75 Ca Cl2 N O4 -","- C80 H236 Ca16 Cl32 N16 O64 -","16","4","AL0497","Ezpeleta, J. M.; Zúñiga, F. J.; Pérez-Mato, J. M.; Paciorek, W. A.; Breczewski, T.","Structural analysis of the fourfold phase of betaine calcium chloride dihydrate at 90 K","Acta Crystallographica Section B","1992","48","3","261","269","10.1107/S0108768191013472","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100770","15.283","0.002","11.716","0.002","10.783","0.001","90","","91.37","0.01","90","","1930.2","0.5","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C42 H32 Cu2 O6 -","- C42 H32 Cu2 O12 -","- C84 H64 Cu4 O24 -","2","0.5","AS0548","Kawata, T.; Uekusa, H.; Ohba, S.; Furukawa, T.; Tokii, T.; Muto, Y.; Kato, M.","Magneto-structural correlation in dimeric copper(II) benzoates","Acta Crystallographica Section B","1992","48","3","253","261","10.1107/S0108768191012697","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100771","17.326","0.002","10.554","0.001","10.655","0.002","90","","95.56","0.01","90","","1939.2","0.5","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C40 H34 Cu2 N2 O8 -","- C40 H34 Cu2 N2 O8 -","- C80 H68 Cu4 N4 O16 -","2","0.5","AS0548","Kawata, T.; Uekusa, H.; Ohba, S.; Furukawa, T.; Tokii, T.; Muto, Y.; Kato, M.","Magneto-structural correlation in dimeric copper(II) benzoates","Acta Crystallographica Section B","1992","48","3","253","261","10.1107/S0108768191012697","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100772","10.684","0.003","10.78","0.002","10.207","0.002","92.55","0.02","109.78","0.03","68.44","0.02","1024.5","0.5","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H38 Cu2 N2 O8 -","- C48 H38 Cu2 N2 O8 -","- C48 H38 Cu2 N2 O8 -","1","0.5","AS0548","Kawata, T.; Uekusa, H.; Ohba, S.; Furukawa, T.; Tokii, T.; Muto, Y.; Kato, M.","Magneto-structural correlation in dimeric copper(II) benzoates","Acta Crystallographica Section B","1992","48","3","253","261","10.1107/S0108768191012697","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100773","18.029","0.003","20.427","0.002","11.673","0.003","90","","97.76","0.02","90","","4259.5","1.4","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C48 H38 Cu2 N2 O4 -","- C48 H38 Cu2 N2 O8 -","- C192 H152 Cu8 N8 O32 -","4","1","AS0548","Kawata, T.; Uekusa, H.; Ohba, S.; Furukawa, T.; Tokii, T.; Muto, Y.; Kato, M.","Magneto-structural correlation in dimeric copper(II) benzoates","Acta Crystallographica Section B","1992","48","3","253","261","10.1107/S0108768191012697","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100774","10.657","0.002","11.047","0.002","10.64","0.002","97.79","0.01","115.08","0.01","69.13","0.01","1059.9","0.4","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C46 H30 Cl4 Cu2 N2 O8 -","- C46 H30 Cl4 Cu2 N2 O8 -","- C46 H30 Cl4 Cu2 N2 O8 -","1","0.5","AS0548","Kawata, T.; Uekusa, H.; Ohba, S.; Furukawa, T.; Tokii, T.; Muto, Y.; Kato, M.","Magneto-structural correlation in dimeric copper(II) benzoates","Acta Crystallographica Section B","1992","48","3","253","261","10.1107/S0108768191012697","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100775","12.922","0.002","22.122","0.002","10.898","0.001","90","","99.42","0.01","90","","3073.3","0.6","","","","","","","","","","","","5","P 1 21/n 1","-P 2yn","14","","","","- C60 H60 Cu2 N16 O16 -","- C60 H60 Cu2 N16 O16 -","- C120 H120 Cu4 N32 O32 -","2","0.5","AS0548","Kawata, T.; Uekusa, H.; Ohba, S.; Furukawa, T.; Tokii, T.; Muto, Y.; Kato, M.","Magneto-structural correlation in dimeric copper(II) benzoates","Acta Crystallographica Section B","1992","48","3","253","261","10.1107/S0108768191012697","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100776","10.461","0.004","10.942","0.004","21.799","0.008","90","","96.97","0.03","90","","2476.8","1.6","","","","","","","","","","","","6","P 1 21/c 1","-P 2ybc","","","","","- C9.5 H12 N Na O5.5 S -","- C9.5 N Na O5.5 S -","- C76 N8 Na8 O44 S8 -","8","2","BX0565","Rudert, R.; Buschmann, J.; Luger, P.; Trummlitz, G.","Structures of 4-methoxy-, 5-chloro-, 5-nitro- and 6-nitro-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide sodium salt (4-methoxy-, 5-chloro-, 5-nitro- and 6-nitrosaccharin)","Acta Crystallographica Section B","1992","48","3","269","275","10.1107/S0108768191014738","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","283803","2023-05-16","08:05:53",""
"2100777","4.71","0.001","29.686","0.007","6.982","0.002","90","","92.19","0.02","90","","975.5","0.4","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C7 H5 Cl N Na O4 S -","- C7 Cl N Na O4 S -","- C28 Cl4 N4 Na4 O16 S4 -","4","1","BX0565","Rudert, R.; Buschmann, J.; Luger, P.; Trummlitz, G.","Structures of 4-methoxy-, 5-chloro-, 5-nitro- and 6-nitro-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide sodium salt (4-methoxy-, 5-chloro-, 5-nitro- and 6-nitrosaccharin)","Acta Crystallographica Section B","1992","48","3","269","275","10.1107/S0108768191014738","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100778","15.559","0.004","6.788","0.004","4.753","0.002","90","","92.31","0.02","90","","501.6","0.4","","","","","","","","","","","","6","P 1 21 1","P 2yb","4","","","","- C7 H5 N2 Na O6 S -","- C7 N2 Na O6 S -","- C14 N4 Na2 O12 S2 -","2","1","BX0565","Rudert, R.; Buschmann, J.; Luger, P.; Trummlitz, G.","Structures of 4-methoxy-, 5-chloro-, 5-nitro- and 6-nitro-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide sodium salt (4-methoxy-, 5-chloro-, 5-nitro- and 6-nitrosaccharin)","Acta Crystallographica Section B","1992","48","3","269","275","10.1107/S0108768191014738","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","205898","2020-10-21","18:00:00",""
"2100779","12.827","0.005","7.276","0.003","7.616","0.004","72.69","0.04","74.33","0.04","75.29","0.03","641.6","0.5","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C7 H11 N2 Na O9 S -","- C7 N2 Na O11 S -","- C14 N4 Na2 O22 S2 -","2","1","BX0565","Rudert, R.; Buschmann, J.; Luger, P.; Trummlitz, G.","Structures of 4-methoxy-, 5-chloro-, 5-nitro- and 6-nitro-1,2-benzisothiazol-3(2<i>H</i>)-one 1,1-dioxide sodium salt (4-methoxy-, 5-chloro-, 5-nitro- and 6-nitrosaccharin)","Acta Crystallographica Section B","1992","48","3","269","275","10.1107/S0108768191014738","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:32",""
"2100780","9.114","0.002","23.933","0.004","11.034","0.004","90","","90","","90","","2406.8","1.1","","","","","","","","","","","","4","P b c a","-P 2ac 2ab","","","","","- C13 H14 N2 O3 -","- C13 H14 N2 O3 -","- C104 H112 N16 O24 -","8","1","LI0111","Nigović, B.; Kojić-Prodić, B.; Puntarec, V.; Schagen, J. D.","Structures of three biologically active conjugates of ω-amino acids and plant growth hormone (auxin)","Acta Crystallographica Section B","1992","48","3","297","302","10.1107/S0108768191014155","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100781","5.072","0.001","10.307","0.003","24.856","0.004","90","","90","","90","","1299.4","0.5","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H16 N2 O3 -","- C14 H16 N2 O3 -","- C56 H64 N8 O12 -","4","1","LI0111","Nigović, B.; Kojić-Prodić, B.; Puntarec, V.; Schagen, J. D.","Structures of three biologically active conjugates of ω-amino acids and plant growth hormone (auxin)","Acta Crystallographica Section B","1992","48","3","297","302","10.1107/S0108768191014155","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2100782","9.058","0.003","9.693","0.005","9.843","0.005","102.07","0.06","104.36","0.05","107.02","0.07","762.6","0.8","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C16 H20 N2 O3 -","- C16 H20 N2 O3 -","- C32 H40 N4 O6 -","2","1","LI0111","Nigović, B.; Kojić-Prodić, B.; Puntarec, V.; Schagen, J. D.","Structures of three biologically active conjugates of ω-amino acids and plant growth hormone (auxin)","Acta Crystallographica Section B","1992","48","3","297","302","10.1107/S0108768191014155","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100783","9.721","0.007","11.127","0.006","16.552","0.008","76.9","0.05","81.52","0.05","62.88","0.05","1550","1.7","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H32 N4 Pt S32 -","- C44 H32 N4 Pt S32 -","- C44 H32 N4 Pt S32 -","1","0.5","PA0242","Fettouhi, M.; Ouahab, L.; Grandjean, D.; Toupet, L.","Structure at 293 and 135 K of β-tetrakis[bis(ethylenedithio)tetrathiafulvalene] tetracyanoplatinate(II): β-[BEDT-TTF]~4~[Pt(CN)~4~]","Acta Crystallographica Section B","1992","48","3","275","280","10.1107/S0108768191013769","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100784","9.693","0.004","10.89","0.004","16.521","0.005","77.12","0.03","81.84","0.04","62.7","0.03","1509.1","1","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C44 H32 N4 Pt S32 -","- C44 H32 N4 Pt S32 -","- C44 H32 N4 Pt S32 -","1","0.5","PA0242","Fettouhi, M.; Ouahab, L.; Grandjean, D.; Toupet, L.","Structure at 293 and 135 K of β-tetrakis[bis(ethylenedithio)tetrathiafulvalene] tetracyanoplatinate(II): β-[BEDT-TTF]~4~[Pt(CN)~4~]","Acta Crystallographica Section B","1992","48","3","275","280","10.1107/S0108768191013769","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100785","22.086","0.003","22.086","0.003","9.463","0.003","90","","90","","90","","4616","2","","","","","","","","","","","","3","I 41/a","-I 4ad","","","","","- C12 H8 O4 -","- C12 H8 O4 -","- C192 H128 O64 -","16","","ST0547","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","1,2-Naphthalenedicarboxylic acid: structures of channel clathrates and an unsolvated crystalline phase","Acta Crystallographica Section B","1992","48","3","290","297","10.1107/S0108768191013654","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100786","9.027","0.001","9.234","0.001","7.256","0.001","106.08","0.01","90.79","0.01","111.8","0.01","534.97","0.12","","","","","","","","","","","","3","P -1","-P 1","2","","","","- C12 H8 O4 -","- C12 H8 O4 -","- C24 H16 O8 -","2","1","ST0547","Fitzgerald, L. J.; Gallucci, J. C.; Gerkin, R. E.","1,2-Naphthalenedicarboxylic acid: structures of channel clathrates and an unsolvated crystalline phase","Acta Crystallographica Section B","1992","48","3","290","297","10.1107/S0108768191013654","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100787","14.474","0.002","21.953","0.002","8.203","0.001","90","","90","","90","","2606.5","0.5","","","","","","","","","","","","5","P n 21 a","","","","","","- C11 H12 N4 O2 S -","- C11 H12 N4 O2 S -","- C88 H96 N32 O16 S8 -","8","2","AB0256","Caria, M. R.; Mohamed, R.","Positive indentification of two orthorhombic polymorphs of sulfamerazine (C~11~H~12~N~4~O~2~S), their thermal analyses and structural comparison","Acta Crystallographica Section B","1992","48","4","492","498","10.1107/S0108768192000910","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100788","5.5306","0.0005","5.5344","0.0005","24.984","0.002","90","","90","","90","","764.72","0.12","","","","","","","","","","","","4","A 21 a m","p -2 2a","","","","","- Bi2 O9 Sr Ta2 -","- Bi2 O9 Sr Ta2 -","- Bi8 O36 Sr4 Ta8 -","4","0.5","AL0520","Rae, A. D.; Thompson, J. G.; Withers, R. L.","Structure refinement of commensurately modulated bismuth strontium tantalate, Bi~2~SrTa~2~O~9~","Acta Crystallographica Section B","1992","48","4","418","428","10.1107/S0108768192001654","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100789","5.199","0.001","16.832","0.001","20.076","0.003","90","","90","","90","","1756.8","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","","","","","- C13 H28 N4 O8 -","- C13 H28 N4 O8 -","- C52 H112 N16 O32 -","4","1","AS0537","Ramaswamy, S.; Murthy, M. R. N.","Crystal and molecular structures of propanediamine complexed with <small>L</small>- and <small>DL</small>-glutamic acid: effect of chirality on propanediamine","Acta Crystallographica Section B","1992","48","4","488","492","10.1107/S010876819200065X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100790","15.219","0.002","5.169","0.001","22.457","0.004","90","","90","","90","","1766.6","0.5","","","","","","","","","","","","4","P n a 21","P 2c -2n","","","","","- C13 H28 N4 O8 -","- C13 H28 N4 O8 -","- C52 H112 N16 O32 -","4","1","AS0537","Ramaswamy, S.; Murthy, M. R. N.","Crystal and molecular structures of propanediamine complexed with <small>L</small>- and <small>DL</small>-glutamic acid: effect of chirality on propanediamine","Acta Crystallographica Section B","1992","48","4","488","492","10.1107/S010876819200065X","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100791","9.2536","0.0001","9.2536","0.0001","16.7028","0.0005","90","","90","","120","","1238.63","0.04","","","","","","","","","","","","5","R -3","-R 3","","","","","- C12 H30 Cl3 Co N6 -","- C12 H30 Cl3 Co N6 -","- C36 H90 Cl9 Co3 N18 -","3","","AS0590","Morooka, M.; Ohba, S.; Toriumi, K.","Electron-density distribution in crystals of 1,4,7,10,13,16-hexaazacyclooctadecanecobalt(III) trichloride, <i>meso</i>-[Co(hexaen)]Cl~3~ at 106 K","Acta Crystallographica Section B","1992","48","4","459","463","10.1107/S0108768192002714","","","0.70926","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100792","7.189","0.002","18.309","0.008","7.665","0.005","90","","92.36","0.014","90","","1008","0.8","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- H12 Mg2 O13 P2 -","- H12 Mg2 O13 P2 -","- H48 Mg8 O52 P8 -","4","1","CR0338","Souhassou, M.; Lecomte, C.; Blessing, R. H.","Crystal chemistry of Mg~2~P~2~O~7~.<i>n</i>H~2~O, <i>n</i> = 0, 2 and 6: magnesium-oxygen coordination and pyrophosphate ligation and conformation","Acta Crystallographica Section B","1992","48","4","370","376","10.1107/S0108768191014313","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100793","10.173","0.001","7.834","0.001","5.1374","0.0007","90","","90","","90","","409.43","0.09","","","","","","","","","","","","3","C m c m","-C 2c 2","","","","","- Al3 La Ni2 -","- Al3 La Ni2 -","- Al12 La4 Ni8 -","4","0.25","DU0308","Gladyshevskii, R. E.; Cenzual, K.; Parthé, E.","LaNi~2~Al~3~, a ternary substitution variant of the orthorhombic BaZn~5~ type","Acta Crystallographica Section B","1992","48","4","389","392","10.1107/S0108768192001502","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100794","5.3791","0.0006","5.3811","0.0009","24.589","0.003","90","","89.93","0.01","90","","711.74","0.17","","","","","","","","","","","","4","A 1 2/a 1","-A 2ya","15","","","","- Bi2.08 Cu O6 Sr1.84 -","- Bi2 Cu O6 Sr2 -","- Bi8 Cu4 O24 Sr8 -","4","0.5","DU0333","Leligny, H.; Durcok, S.; Labbe, P.; Ledesert, M.; Raveau, B.","X-ray investigation of the incommensurate modulated structure of Bi~2.08~Sr~1.84~CuO~6{-~δ}","Acta Crystallographica Section B","1992","48","4","407","418","10.1107/S0108768192002143","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","205831","2020-10-21","18:00:00",""
"2100795","6.162","0.003","11.096","0.002","6.826","0.002","90","","101.64","0.03","90","","457.1","0.3","","","","","","","","","","","","4","P 1 21/m 1","","","","","","- C9 H6 Mo O3 -","- C9 H6 Mo O3 -","- C18 H12 Mo2 O6 -","2","0.5","GE0298","Bürgi, H.-B.; Raselli, A.; Braga, D.; Grepioni, F.","Structure of (η^6^-C~6~H~6~)Mo(CO)~3~ at room temperature and 120 K: motion about equilibrium and far from equilibrium","Acta Crystallographica Section B","1992","48","4","428","437","10.1107/S0108768191014404","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100796","6.028","0.001","11.001","0.002","6.763","0.001","90","","100.79","0.01","90","","440.55","0.13","","","","","","","","","","","","4","P 1 21/m 1","","","","","","- C9 H6 Mo O3 -","- C9 H6 Mo O3 -","- C18 H12 Mo2 O6 -","2","0.5","GE0298","Bürgi, H.-B.; Raselli, A.; Braga, D.; Grepioni, F.","Structure of (η^6^-C~6~H~6~)Mo(CO)~3~ at room temperature and 120 K: motion about equilibrium and far from equilibrium","Acta Crystallographica Section B","1992","48","4","428","437","10.1107/S0108768191014404","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100797","13.264","0.002","6.682","0.002","10.7697","0.0009","90","","90","","90","","954.5","0.3","","","","","","","","","","","","4","P n a 21","","","","","","- As O5 Rb Ti -","- As2 O10 Rb2 Ti2 -","- As8 O40 Rb8 Ti8 -","4","1","HA0083","Thomas, P. A.; Mayo, S. C.; Watts, B. E.","Crystal structures of RbTiOAsO~4~, KTiO(P~0.58~,As~0.42~)O~4~, RbTiOPO~4~ and (Rb~0.465~,K~0.535~)TiOPO~4~, and analysis of pseudosymmetry in crystals of the KTiOPO~4~ family","Acta Crystallographica Section B","1992","48","4","401","407","10.1107/S0108768192002465","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100798","12.962","0.002","6.479","0.002","10.691","0.003","90","","90","","90","","897.8","0.4","","","","","","","","","","","","5","P n a 21","","","","","","- As K O5 P Ti -","- As K2 O10 P Ti2 -","- As4 K8 O40 P4 Ti8 -","4","1","HA0083","Thomas, P. A.; Mayo, S. C.; Watts, B. E.","Crystal structures of RbTiOAsO~4~, KTiO(P~0.58~,As~0.42~)O~4~, RbTiOPO~4~ and (Rb~0.465~,K~0.535~)TiOPO~4~, and analysis of pseudosymmetry in crystals of the KTiOPO~4~ family","Acta Crystallographica Section B","1992","48","4","401","407","10.1107/S0108768192002465","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100799","12.974","0.002","6.494","0.003","10.564","0.006","90","","90","","90","","890.1","0.7","","","","","","","","","","","","4","P n a 21","","","","","","- O5 P Rb Ti -","- O10 P2 Rb2 Ti2 -","- O40 P8 Rb8 Ti8 -","4","1","HA0083","Thomas, P. A.; Mayo, S. C.; Watts, B. E.","Crystal structures of RbTiOAsO~4~, KTiO(P~0.58~,As~0.42~)O~4~, RbTiOPO~4~ and (Rb~0.465~,K~0.535~)TiOPO~4~, and analysis of pseudosymmetry in crystals of the KTiOPO~4~ family","Acta Crystallographica Section B","1992","48","4","401","407","10.1107/S0108768192002465","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100800","12.908","0.006","6.436","0.003","10.597","0.005","90","","90","","90","","880.4","0.7","","","","","","","","","","","","5","P n a 21","","","","","","- K O5 P Rb Ti -","- K O10 P2 Rb Ti2 -","- K4 O40 P8 Rb4 Ti8 -","4","1","HA0083","Thomas, P. A.; Mayo, S. C.; Watts, B. E.","Crystal structures of RbTiOAsO~4~, KTiO(P~0.58~,As~0.42~)O~4~, RbTiOPO~4~ and (Rb~0.465~,K~0.535~)TiOPO~4~, and analysis of pseudosymmetry in crystals of the KTiOPO~4~ family","Acta Crystallographica Section B","1992","48","4","401","407","10.1107/S0108768192002465","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100801","11.879","0.001","16.754","0.001","12.637","0.001","96.824","0.003","116.169","0.003","87.313","0.004","2241.2","0.3","","","","","","","","","","","","5","P -1","-P 1","2","","","","- C48 H65 P2 Re Si2 -","- C48 H65 P2 Re Si2 -","- C96 H130 P4 Re2 Si4 -","2","1","HA0088","Howard, J. A. K.; Keller, P. A.; Vogt, T.; Taylor, A. L.; Dix, N. D.; Spencer, J. L.","Low-temperature neutron diffraction study of [ReH~5~(PPh^<i>i^</i>Pr~2~)~2~(SiHPh~2~)~2~] and low-temperature X-ray diffraction study of [ReH~5~(PCyp~3~)~2~(SiH~2~Ph)~2~]","Acta Crystallographica Section B","1992","48","4","438","444","10.1107/S0108768191014428","","","1.3168","Ge","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100802","12.448","0.002","17.579","0.004","19.433","0.004","90","","90","","90","","4252.4","1.5","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C42 H73 P2 Re Si2 -","- C42 H68 P2 Re Si2 -","- C168 H272 P8 Re4 Si8 -","4","1","HA0088","Howard, J. A. K.; Keller, P. A.; Vogt, T.; Taylor, A. L.; Dix, N. D.; Spencer, J. L.","Low-temperature neutron diffraction study of [ReH~5~(PPh^<i>i^</i>Pr~2~)~2~(SiHPh~2~)~2~] and low-temperature X-ray diffraction study of [ReH~5~(PCyp~3~)~2~(SiH~2~Ph)~2~]","Acta Crystallographica Section B","1992","48","4","438","444","10.1107/S0108768191014428","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2100803","11.154","0.003","12.685","0.002","12.713","0.002","100.68","0.01","113.58","0.01","104.5","0.02","1511.2","0.6","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C17 H19 Cl O -","- C17 H19 Cl O -","- C68 H76 Cl4 O4 -","4","2","LI0118","Venugopalan, P.; Venkatesan, K.","Solid-state photobehaviour and crystal packing of <i>o</i>-chlorobenzylidene-<small>DL</small>-piperitone: influence of molecular topology on photobehaviour","Acta Crystallographica Section B","1992","48","4","532","537","10.1107/S0108768192002167","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:32",""
"2100804","3.86","0.001","3.86","0.001","11.813","0.004","90","","90","","90","","176.05","0.07","","","","","","","","","","","","4","P 4/m m m","-P 4 2","","","","","- Ba2 Cu3 O6 Y -","- Ba2 Cu3 O8 Y -","- Ba2 Cu3 O8 Y -","1","0.0625","OH0012","Sasaki, S.; Inoue, Z.; Iyi, N.; Takekawa, S.","Electron density study of YBa~2~Cu~3~O~6+{δ~}","Acta Crystallographica Section B","1992","48","4","393","400","10.1107/S0108768192000405","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","191108","2020-10-21","18:00:00",""
"2100805","21.228","0.006","8.02","0.002","20.865","0.005","90","","105.2","0.1","90","","3428","2","","","","","","","","","","","","7","C 1 c 1","C -2yc","","","","","- C31 H32 B2 Cl2 Fe2 N6 O7 -","- C31 H32 B2 Cl2 Fe2 N6 O7 -","- C124 H128 B8 Cl8 Fe8 N24 O28 -","4","1","ST0523","Vasilevsky, I.; Rose, N. J.; Stenkamp, R. E.","Structural studies of oxygen-bridged iron compounds","Acta Crystallographica Section B","1992","48","4","444","449","10.1107/S0108768192000107","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100806","11.86","0.002","20.911","0.005","16.175","0.003","90","","92.88","0.01","90","","4006.4","1.4","","","","","","","","","","","","7","P 1 21/n 1","-P 2yn","14","","","","- C34 H38 B2 Cl2 Fe2 N8 O8 -","- C34 H38 B2 Cl2 Fe2 N8 O8 -","- C136 H152 B8 Cl8 Fe8 N32 O32 -","4","1","ST0523","Vasilevsky, I.; Rose, N. J.; Stenkamp, R. E.","Structural studies of oxygen-bridged iron compounds","Acta Crystallographica Section B","1992","48","4","444","449","10.1107/S0108768192000107","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:53",""
"2100807","10.535","0.013","13.91","0.02","15.18","0.02","91.67","0.12","106.45","0.11","94.53","0.12","2124","5","","","","","","","","","","","","7","P -1","-P 1","2","","","","- C38 H45 B2 Cl3 Fe2 N6 O8 -","- C38 H45 B2 Cl3 Fe2 N6 O8 -","- C76 H90 B4 Cl6 Fe4 N12 O16 -","2","1","ST0523","Vasilevsky, I.; Rose, N. J.; Stenkamp, R. E.","Structural studies of oxygen-bridged iron compounds","Acta Crystallographica Section B","1992","48","4","444","449","10.1107/S0108768192000107","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:32",""
"2100808","10.8921","0.0015","6.3864","0.0009","8.4441","0.0012","90","","112.422","0.012","90","","542.98","0.14","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","","","","","- Cs3 H O8 Se2 -","- Cs3 H O8 Se2 -","- Cs6 H2 O16 Se4 -","2","0.25","AB0279","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structural study of the low-temperature phase transition in Cs~3~D(SeO~4~)~2~","Acta Crystallographica Section B","1992","48","5","633","639","10.1107/S0108768192004154","","","0.56087","Ag","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100809","10.8911","0.0009","6.383","0.0003","8.4483","0.0016","90","","112.45","0.02","90","","542.8","0.14","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","","","","","- Cs3 D O8 Se2 -","- Cs3 D O8 Se2 -","- Cs6 D2 O16 Se4 -","2","0.25","AB0279","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structural study of the low-temperature phase transition in Cs~3~D(SeO~4~)~2~","Acta Crystallographica Section B","1992","48","5","633","639","10.1107/S0108768192004154","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100810","10.8465","0.0007","6.3551","0.0002","8.404","0.0012","90","","112.385","0.016","90","","535.64","0.11","","","","","","","","","","","","4","C 1 2/m 1","-C 2y","","","","","- Cs3 D O8 Se2 -","- Cs3 D O8 Se2 -","- Cs6 D2 O16 Se4 -","2","0.25","AB0279","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structural study of the low-temperature phase transition in Cs~3~D(SeO~4~)~2~","Acta Crystallographica Section B","1992","48","5","633","639","10.1107/S0108768192004154","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100811","10.7906","0.0011","6.3264","0.0003","8.367","0.002","90","","112.22","0.03","90","","528.76","0.18","","","","","","","","","","","","4","P 1 21/m 1","-P 2yb","11","","","","- Cs3 D O8 Se2 -","- Cs3 D O8 Se2 -","- Cs6 D2 O16 Se4 -","2","0.5","AB0279","Ichikawa, M.; Gustafsson, T.; Olovsson, I.","Structural study of the low-temperature phase transition in Cs~3~D(SeO~4~)~2~","Acta Crystallographica Section B","1992","48","5","633","639","10.1107/S0108768192004154","","","0.7093","Mo","","","","","","","","","","","","","","","","","has coordinates","205956","2020-10-21","18:00:00",""
"2100812","5.388","0.001","5.447","0.001","7.654","0.001","90","","90","","90","","224.63","0.07","","","","","","","","","","","","3","P b n m","","","","","","- Ca O3 Ti -","- Ca O3 Ti -","- Ca4 O12 Ti4 -","4","0.5","AS0543","Buttner, R. H.; Maslen, E. N.","Electron difference density and structural parameters in CaTiO~3~","Acta Crystallographica Section B","1992","48","5","644","649","10.1107/S0108768192004592","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100813","11.144","0.001","18.291","0.002","9.206","0.001","97.56","0.01","100.53","0.01","84.05","0.01","1822.8","0.3","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C22 H18 Cl12 Cu2 N2 O8 -","- C22 H18 Cl12 Cu2 N2 O8 -","- C44 H36 Cl24 Cu4 N4 O16 -","2","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100814","21.544","0.004","18.099","0.004","11.423","0.002","90","","99.49","0.02","90","","4393.2","1.5","","","","","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","","","- C29 H26 Cl12 Cu2 N2 O8 -","- C29 Cl12 Cu2 N2 O8 -","- C116 Cl48 Cu8 N8 O32 -","4","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","278324","2022-10-03","14:41:53",""
"2100815","21.01","0.001","18.725","0.002","11.574","0.001","90","","104.9","0.01","90","","4400.3","0.7","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C29 H26 Cl12 Cu2 N2 O8 -","- C29 H26 Cl12 Cu2 N2 O8 -","- C116 H104 Cl48 Cu8 N8 O32 -","4","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208452","2020-10-21","18:00:00",""
"2100816","20.567","0.002","10.414","0.002","18.231","0.002","90","","106.13","0.01","90","","3751.1","0.9","","","","","","","","","","","","6","P 1 21/c 1","","","","","","- C22 H18 Cl12 Cu2 N2 O8 -","- C22 H18 Cl12 Cu2 N2 O8 -","- C88 H72 Cl48 Cu8 N8 O32 -","4","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208420","2020-10-21","18:00:00",""
"2100817","13.603","0.002","14.122","0.002","9.796","0.002","98.269","0.001","93.762","0.001","80.286","0.001","1833.9","0.5","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H6 Cl14 Cu2 N4 O12 -","- C18 H6 Cl14 Cu2 N4 O12 -","- C36 H12 Cl28 Cu4 N8 O24 -","2","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208433","2020-10-21","18:00:00",""
"2100818","20.048","0.002","17.575","0.002","12.35","0.001","90","","106.01","0.02","90","","4182.7","0.8","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C24 H20 Cl12 Cu2 N8 O12 -","- C24 H20 Cl12 Cu2 N8 O12 -","- C96 H80 Cl48 Cu8 N32 O48 -","4","0.5","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2100819","10.953","0.001","16.338","0.002","10.833","0.001","106.8","0.01","97.02","0.01","71.9","0.01","1762.9","0.3","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C20 H8 Cl12 Cu2 N4 O8 -","- C20 H8 Cl12 Cu2 N4 O8 -","- C40 H16 Cl24 Cu4 N8 O16 -","2","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100820","20.37","0.002","18.296","0.003","11.505","0.002","90","","100.35","0.01","90","","4218","1.1","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C24 H12 Cl16 Cu2 N2 O8 -","- C24 H12 Cl16 Cu2 N2 O8 -","- C96 H48 Cl64 Cu8 N8 O32 -","4","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208452","2020-10-21","18:00:00",""
"2100821","11.359","0.001","17.928","0.002","9.324","0.001","97.35","0.01","103.04","0.01","92.66","0.01","1829","0.3","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H6 Cl16 Cu2 N2 O8 -","- C18 H6 Cl16 Cu2 N2 O8 -","- C36 H12 Cl32 Cu4 N4 O16 -","2","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","208428","2020-10-21","18:00:00",""
"2100822","10.246","0.001","10.739","0.001","9.598","0.001","103.27","0.01","111.23","0.01","62.36","0.01","869.65","0.18","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C18 H8 Cl14 Cu2 N2 O8 -","- C18 H8 Cl14 Cu2 N2 O8 -","- C18 H8 Cl14 Cu2 N2 O8 -","1","0.5","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100823","15.731","0.002","15.731","0.002","19.115","0.003","90","","90","","90","","4730.3","1.1","","","","","","","","","","","","6","P 42/n c m :2","-P 4ac 2ac","138","","","","- C30 H26 Cl12 Cu2 N4 O10 -","- C30 Cl12 Cu2 N4 O10 -","- C120 Cl48 Cu8 N16 O40 -","4","0.25","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208430","2020-10-21","18:00:00",""
"2100824","20.788","0.005","17.951","0.004","9.693","0.002","90","","99.45","0.02","90","","3568","1.4","","","","","","","","","","","","6","P 1 21/a 1","-P 2yab","14","","","","- C20 H8 Cl12 Cu2 N4 O8 -","- C20 H8 Cl12 Cu2 N4 O8 -","- C80 H32 Cl48 Cu8 N16 O32 -","4","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208452","2020-10-21","18:00:00",""
"2100825","10.201","0.001","11.688","0.002","9.301","0.001","107.37","0.01","100.45","0.01","73.99","0.01","1011.4","0.2","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H10 Cl16 Cu2 N2 O8 -","- C26 H10 Cl16 Cu2 N2 O8 -","- C26 H10 Cl16 Cu2 N2 O8 -","1","0.5","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100826","10.336","0.002","11.381","0.003","9.272","0.001","107.3","0.01","94.63","0.02","66.53","0.02","954.3","0.4","","","","","","","","","","","","8","P -1","-P 1","2","","","","- C22 H8 Cl12 Cu2 F2 N2 O8 S2 -","- C22 H8 Cl12 Cu2 F2 N2 O8 S2 -","- C22 H8 Cl12 Cu2 F2 N2 O8 S2 -","1","0.5","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100827","10.859","0.002","19.225","0.002","10.692","0.002","91.01","0.01","97.89","0.02","81.11","0.01","2184.4","0.6","","","","","","","","","","","","6","P -1","-P 1","2","","","","- C25 H14 Cl16 Cu2 N2 O8 -","- C25 H14 Cl16 Cu2 N2 O8 -","- C50 H28 Cl32 Cu4 N4 O16 -","2","1","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100828","19.547","0.003","14.99","0.001","17.181","0.003","90","","106.93","0.02","90","","4816","1.3","","","","","","","","","","","","6","C 1 2/c 1","-C 2yc","15","","","","- C34 H30 Cl12 Cu2 N2 O8 -","- C34 H30 Cl12 Cu2 N2 O8 -","- C136 H120 Cl48 Cu8 N8 O32 -","4","0.5","AS0591","Uekusa, H.; Ohba, S.; Tokii, T.; Muto, Y.; Kato, M.; Husebye, S.; Steward, O. W.; Chang, S.-C.; Rose, J. P.; Pletcher, J. F.; Suzuki, I.","Magneto-structural corrections of dimeric copper(II) trichloroacetates","Acta Crystallographica Section B","1992","48","5","650","667","10.1107/S0108768192002908","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates,has disorder","208433","2020-10-21","18:00:00",""
"2100829","10.176","0.002","8.692","0.001","10.746","0.002","90","","95.45","0.02","90","","946.2","0.3","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H18 N6 O2 -","- Cl8 Co4 H72 N24 O8 -","4","0.5","AS0597","Kubota, M.; Ohba, S.","Nitro-nitrito linkage photoisomerization in crystals of pentaamminenitrocobalt(III) dichloride","Acta Crystallographica Section B","1992","48","5","627","632","10.1107/S010876819200404X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100830","10.187","0.003","8.704","0.003","10.727","0.003","90","","95.43","0.03","90","","946.9","0.5","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H18 N8 O5 -","- Cl8 Co4 H72 N32 O20 -","4","0.5","AS0597","Kubota, M.; Ohba, S.","Nitro-nitrito linkage photoisomerization in crystals of pentaamminenitrocobalt(III) dichloride","Acta Crystallographica Section B","1992","48","5","627","632","10.1107/S010876819200404X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100831","10.191","0.005","8.739","0.004","10.682","0.004","90","","95.38","0.06","90","","947.1","0.7","","","","","","","","","","","","5","C 1 2/c 1","-C 2yc","","","","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H18 N8 O5 -","- Cl8 Co4 H72 N32 O20 -","4","0.5","AS0597","Kubota, M.; Ohba, S.","Nitro-nitrito linkage photoisomerization in crystals of pentaamminenitrocobalt(III) dichloride","Acta Crystallographica Section B","1992","48","5","627","632","10.1107/S010876819200404X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100832","10.349","0.002","13.228","0.003","6.864","0.002","90","","90","","90","","939.7","0.4","","","","","","","","","","","","5","P 21 n b","","","","","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N7 O4 -","- Cl8 Co4 H60 N28 O16 -","4","1","AS0597","Kubota, M.; Ohba, S.","Nitro-nitrito linkage photoisomerization in crystals of pentaamminenitrocobalt(III) dichloride","Acta Crystallographica Section B","1992","48","5","627","632","10.1107/S010876819200404X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100833","10.376","0.001","13.355","0.003","6.8307","0.0007","90","","90","","90","","946.5","0.3","","","","","","","","","","","","5","P 21 n b","","","","","","- Cl2 Co H15 N6 O2 -","- Cl2 Co H15 N7 O4 -","- Cl8 Co4 H60 N28 O16 -","4","1","AS0597","Kubota, M.; Ohba, S.","Nitro-nitrito linkage photoisomerization in crystals of pentaamminenitrocobalt(III) dichloride","Acta Crystallographica Section B","1992","48","5","627","632","10.1107/S010876819200404X","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100834","13.029","0.002","13.029","0.002","10.04","0.002","90","","90","","120","","1476","0.4","","","","","","","","","","","","5","P 63","","","","","","- C18 H48 Cr N9 O12 -","- C18 H48 Cr N9 O12 -","- C36 H96 Cr2 N18 O24 -","2","0.333333","AS0599","Morooka, M.; Ohba, S.; Miyamae, H.","Electron-density distribution in crystals of <i>lel</i>~3~-[<i>M</i>(chxn)~3~](NO~3~)~3~.3H~2~O (<i>M</i> = Cr, Rh; chxn = <i>trans</i>-1,2-diaminocyclohexane) at 120 K","Acta Crystallographica Section B","1992","48","5","667","672","10.1107/S0108768192004257","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","190627","2020-10-21","18:00:00",""
"2100835","13.101","0.002","13.101","0.002","9.984","0.002","90","","90","","120","","1484","0.4","","","","","","","","","","","","5","P 63","","","","","","- C18 H48 N9 O12 Rh -","- C18 H48 N9 O12 Rh -","- C36 H96 N18 O24 Rh2 -","2","0.333333","AS0599","Morooka, M.; Ohba, S.; Miyamae, H.","Electron-density distribution in crystals of <i>lel</i>~3~-[<i>M</i>(chxn)~3~](NO~3~)~3~.3H~2~O (<i>M</i> = Cr, Rh; chxn = <i>trans</i>-1,2-diaminocyclohexane) at 120 K","Acta Crystallographica Section B","1992","48","5","667","672","10.1107/S0108768192004257","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","190627","2020-10-21","18:00:00",""
"2100836","3.817","0.001","6.516","0.001","13.531","0.002","93.11","0.01","86.97","0.01","95.02","0.01","334.36","0.11","","","","","","","","","","","","4","P -1","-P 1","2","","","","- C18 H12 N2 O2 -","- C18 H12 N2 O2 -","- C18 H12 N2 O2 -","1","0.5","BX0577","Mizuguchi, J.; Grubenmann, A.; Wooden, G.; Rihs, G.","Structures of 3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione and 2,5-dimethyl-3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione","Acta Crystallographica Section B","1992","48","5","696","700","10.1107/S0108768192003033","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100837","11.666","0.001","12.003","0.001","10.779","0.001","90","","90","","90","","1509.4","0.2","","","","","","","","","","","","4","P b c n","","","","","","- C20 H16 N2 O2 -","- C20 H16 N2 O2 -","- C80 H64 N8 O8 -","4","0.5","BX0577","Mizuguchi, J.; Grubenmann, A.; Wooden, G.; Rihs, G.","Structures of 3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione and 2,5-dimethyl-3,6-diphenylpyrrolo[3,4-<i>c</i>]pyrrole-1,4-dione","Acta Crystallographica Section B","1992","48","5","696","700","10.1107/S0108768192003033","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100838","7.349","0.001","7.203","0.002","24.729","0.004","90","","91.27","0.01","90","","1308.7","0.5","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C15 H14 O2 S -","- C15 H14 O2 S -","- C60 H56 O8 S4 -","4","1","CR0384","Brock, C. P.; Kwiatkowski, S.; Watt, D. S.; Sayed, A.","Two closely related structures: ({-})-(7a<i>S</i>)-2,3,7,7a-tetrahydro-7a-phenylthio-1<i>H</i>-indene-1,5(6<i>H</i>)-dione and its racemic compound","Acta Crystallographica Section B","1992","48","5","719","725","10.1107/S0108768192003574","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2100839","7.3342","0.0008","7.3587","0.0004","24.613","0.006","90","","90","","90","","1328.4","0.4","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C15 H14 O2 S -","- C15 H14 O2 S -","- C60 H56 O8 S4 -","4","1","CR0384","Brock, C. P.; Kwiatkowski, S.; Watt, D. S.; Sayed, A.","Two closely related structures: ({-})-(7a<i>S</i>)-2,3,7,7a-tetrahydro-7a-phenylthio-1<i>H</i>-indene-1,5(6<i>H</i>)-dione and its racemic compound","Acta Crystallographica Section B","1992","48","5","719","725","10.1107/S0108768192003574","","","1.5406","Cu","","","","","","","","","","","","","","","","","has coordinates","208158","2020-10-21","18:00:00",""
"2100840","6.094","0.0008","6.094","0.0008","6.094","0.0008","90","","90","","90","","226.31","0.05","","","","","","","","","","","","2","P a -3","-P 2ac 2ab 3","","","","","- C2 H2 -","- C2 H2 -","- C8 H8 -","4","0.166667","CR0402","McMullan, R. K.; Kvick, Å.; Popelier, P.","Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction","Acta Crystallographica Section B","1992","48","5","726","731","10.1107/S0108768192004774","","neutron","1.0402","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100841","6.105","0.0008","6.105","0.0008","6.105","0.0008","90","","90","","90","","227.54","0.05","","","","","","","","","","","","2","P a -3","-P 2ac 2ab 3","","","","","- C2 H2 -","- C2 H2 -","- C8 H8 -","4","0.166667","CR0402","McMullan, R. K.; Kvick, Å.; Popelier, P.","Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction","Acta Crystallographica Section B","1992","48","5","726","731","10.1107/S0108768192004774","","neutron","1.0402","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100842","6.102","0.0007","6.102","0.0007","6.102","0.0007","90","","90","","90","","227.2","0.05","","","","","","","","","","","","2","P a -3","-P 2ac 2ab 3","","","","","- C2 D2 -","- C2 D2 -","- C8 D8 -","4","0.166667","CR0402","McMullan, R. K.; Kvick, Å.; Popelier, P.","Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction","Acta Crystallographica Section B","1992","48","5","726","731","10.1107/S0108768192004774","","neutron","1.0402","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100843","6.198","0.004","6.023","0.004","5.578","0.002","90","","90","","90","","208.2","0.2","","","","","","","","","","","","2","A c a m","","","","","","- C2 D2 -","- C2 D2 -","- C8 D8 -","4","","CR0402","McMullan, R. K.; Kvick, Å.; Popelier, P.","Structures of cubic and orthorhombic phases of acetylene by single-crystal neutron diffraction","Acta Crystallographica Section B","1992","48","5","726","731","10.1107/S0108768192004774","","neutron","1.0402","neutron","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100844","10.2501","0.0005","10.2501","0.0005","10.2501","0.0005","90","","90","","90","","1076.9","0.2","","","","","","","","","","","","2","I 2 3","I 2 2 3","","","","","- Bi2 O3 -","- Bi13 O20 -","- Bi26 O40 -","2","0.0833333","DU0321","Radaev, S. F.; Simonov, V. I.; Kargin, Yu. F.","Structural features of γ-phase Bi~2~O~3~ and its place in the sillenite family","Acta Crystallographica Section B","1992","48","5","604","609","10.1107/S0108768192003847","","neutron","2.3145","neutron","","","","","","","","","","","","","","","","","has coordinates","287670","2023-11-17","14:28:49",""
"2100845","6.74","0.005","12.26","0.03","18.524","0.006","90","","90.01","0.04","90","","1531","4","293","","293","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","1-hydroxy-8-morpholino-tricyclo[6.5.0.02,7]trideca-2,4,6-triene (compound 2)","","- C17 H23 N O2 -","- C17 H23 N O2 -","- C68 H92 N4 O8 -","4","1","GE0307","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new bronchospasmolytic agents. II","Acta Crystallographica Section B","1992","48","5","687","695","10.1107/S0108768192002647","","","0.71069","XrayMoKalphamean","","","0.0372","","","0.0435","","","","","0.7921","0.7921","","","","","has coordinates","278324","2022-10-03","14:41:54",""
"2100846","10.676","0.004","13.31","0.004","14.042","0.002","99.09","0.02","112.11","0.02","95.03","0.03","1801.6","1","293","","293","","","","","","","","","4","P -1","-P 1","2","","1-hydroxy-8-morpholino-tricyclo[6.5.0.02,7]trideca-2,4,6-triene-13- -spiro-(2'-1',3'-dioxan) (compound 3)","","- C20 H27 N O4 -","- C20 H27 N O4 -","- C80 H108 N4 O16 -","4","2","GE0307","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new bronchospasmolytic agents. II","Acta Crystallographica Section B","1992","48","5","687","695","10.1107/S0108768192002647","","","0.71069","XrayMoKalphamean","","","0.0389","","","0.0433","","","","","0.9398","0.9398","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100847","30.77","0.02","6.881","0.001","17.867","0.01","90","","99.1","0.08","90","","3735","3","293","","293","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","1-hydroxy-3-(2'-methyl-1',3'-dioxolan)-8-morpholino-tricyclo [6.5.0.02,7]trideca-2,4,6-triene (compound 4)","","- C21 H29 N O4 -","- C21 H29 N O4 -","- C168 H232 N8 O32 -","8","1","GE0307","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new bronchospasmolytic agents. II","Acta Crystallographica Section B","1992","48","5","687","695","10.1107/S0108768192002647","","","0.71069","XrayMoKalphamean","","","0.0392","","","0.0457","","","","","2.4859","2.4859","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2100848","10.017","0.001","10.823","0.002","18.143","0.003","90","","100.81","0.02","90","","1932.1","0.5","293","","293","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","3-diethylamino-1-hydroxy-8-morpholino-tricyclo[6.5.0.02,7]trideca- -2,4,6-triene (compound 5)","","- C21 H32 N2 O2 -","- C21 H32 N2 O2 -","- C84 H128 N8 O8 -","4","1","GE0307","Ianelli, S.; Nardelli, M.; Belletti, D.; Jamart-Grégoire, B.; Mouaddib, A.; Caubère, P.","Synthesis and structure of new bronchospasmolytic agents. II","Acta Crystallographica Section B","1992","48","5","687","695","10.1107/S0108768192002647","","","1.54178","XrayCuKalphamean","","","0.0445","","","0.0467","","","","","0.9179","0.9179","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2100849","22.312","0.011","11.51","0.01","18.744","0.009","90","","90","","90","","4814","5","","","","","","","","","","","","4","P b c a","","","","","","- C31 H23 N2 P -","- C31 H23 N2 P -","- C248 H184 N16 P8 -","8","1","LI0116","Bethell, D.; Brown, M. P.; Harding, M. M.; Herbert, C. A.; Khodaei, M. M.; Rios, M. I.; Woolstencroft, K.","Structures of three diaryl-substituted triphenylphosphazines","Acta Crystallographica Section B","1992","48","5","683","687","10.1107/S0108768192001393","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100850","22.645","0.005","9.19","0.01","12.568","0.002","90","","90","","90","","2615","3","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C33 H27 N2 P -","- C33 H27 N2 P -","- C132 H108 N8 P4 -","4","1","LI0116","Bethell, D.; Brown, M. P.; Harding, M. M.; Herbert, C. A.; Khodaei, M. M.; Rios, M. I.; Woolstencroft, K.","Structures of three diaryl-substituted triphenylphosphazines","Acta Crystallographica Section B","1992","48","5","683","687","10.1107/S0108768192001393","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208466","2020-10-21","18:00:00",""
"2100851","13.73","0.005","17.205","0.01","10.914","0.004","90","","109.36","0.01","90","","2432.4","1.9","","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C31 H25 N2 P -","- C31 H25 N2 P -","- C124 H100 N8 P4 -","4","1","LI0116","Bethell, D.; Brown, M. P.; Harding, M. M.; Herbert, C. A.; Khodaei, M. M.; Rios, M. I.; Woolstencroft, K.","Structures of three diaryl-substituted triphenylphosphazines","Acta Crystallographica Section B","1992","48","5","683","687","10.1107/S0108768192001393","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2100852","42.56","0.11","42.56","0.11","24.61","0.11","90","","90","","90","","44577","","","","","","","","","","","","","5","P 43 21 2","P 41n 2abw","","","","","- C78 H98 N30 O49 P7 -","","","8","1","LI0119","Cervi, A. R.; Langlois d'Estaintot, B.; Hunter, W. N.","Crystal and molecular structure of d(GTCTAGAC)","Acta Crystallographica Section B","1992","48","5","714","719","10.1107/S0108768192004117","","","1.5418","Cu","","","","","","","","","","","","","","","","warnings","has coordinates","249440","2020-10-21","18:00:00",""
"2100853","10.6","0.001","10.6","0.001","14.167","0.002","90","","90","","120","","1378.5","0.3","","","","","","","","","","","","3","R 3 :H","R 3","146","","","","- Cl11 N3 P4 -","- Cl11 N3 P4 -","- Cl33 N9 P12 -","3","0.333333","SE0086","Belaj, F.","Structures and electron density distributions of [Cl-P(NPCl~3~)~3~]^+^.Cl^{-^} and [Cl-P(NPCl~3~)~3~]^+^.PCl~6~^{-^}.1/2C~2~H~2~Cl~4~ at 100 K","Acta Crystallographica Section B","1992","48","5","598","604","10.1107/S010876819200363X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208313","2020-10-21","18:00:00",""
"2100854","16.106","0.003","21.627","0.007","14.899","0.002","90","","90","","90","","5190","2","","","","","","","","","","","","5","C c m e","-C 2ac 2ac","64","","","","- C H Cl18 N3 P5 -","- C H Cl18 N3 P5 -","- C8 H8 Cl144 N24 P40 -","8","0.5","SE0086","Belaj, F.","Structures and electron density distributions of [Cl-P(NPCl~3~)~3~]^+^.Cl^{-^} and [Cl-P(NPCl~3~)~3~]^+^.PCl~6~^{-^}.1/2C~2~H~2~Cl~4~ at 100 K","Acta Crystallographica Section B","1992","48","5","598","604","10.1107/S010876819200363X","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208313","2020-10-21","18:00:00",""
"2100855","12.337","0.002","6.361","0.003","19.891","0.002","90","","96.44","0.01","90","","1551.1","0.8","","","","","","","","","","","","3","P 1 21/a 1","-P 2yab","14","","","","- C22 H24 O -","- C22 H24 O -","- C88 H96 O4 -","4","1","ST0578","Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Reddy, C. M.; Gadgil, V. R.","<i>meso</i>- and <small>D</small>,<small>L</small>-<i>D</i>~3~-trishomocubylidene-<i>D</i>~3~-trishomocubane oxides and <small>D</small>,<small>L</small>-bi-<i>D</i>~3~-trishomocubyl","Acta Crystallographica Section B","1992","48","5","731","737","10.1107/S0108768192004178","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2100856","21.471","0.005","6.352","0.001","12.351","0.003","90","","117.26","0.01","90","","1497.4","0.6","","","","","","","","","","","","3","C 1 2/c 1","-C 2yc","15","","","","- C22 H24 O -","- C22 H24 O -","- C88 H96 O4 -","4","0.5","ST0578","Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Reddy, C. M.; Gadgil, V. R.","<i>meso</i>- and <small>D</small>,<small>L</small>-<i>D</i>~3~-trishomocubylidene-<i>D</i>~3~-trishomocubane oxides and <small>D</small>,<small>L</small>-bi-<i>D</i>~3~-trishomocubyl","Acta Crystallographica Section B","1992","48","5","731","737","10.1107/S0108768192004178","","","1.54178","Cu","","","","","","","","","","","","","","","","","has coordinates","208362","2020-10-21","18:00:00",""
"2100857","6.324","0.001","10.591","0.002","11.767","0.003","103.14","0.02","99.18","0.02","95.67","0.01","750.1","0.3","","","","","","","","","","","","2","P -1","-P 1","2","","","","- C22 H26 -","- C22 H26 -","- C44 H52 -","2","1","ST0578","Watson, W. H.; Kashyap, R. P.; Krawiec, M.; Marchand, A. P.; Reddy, C. M.; Gadgil, V. R.","<i>meso</i>- and <small>D</small>,<small>L</small>-<i>D</i>~3~-trishomocubylidene-<i>D</i>~3~-trishomocubane oxides and <small>D</small>,<small>L</small>-bi-<i>D</i>~3~-trishomocubyl","Acta Crystallographica Section B","1992","48","5","731","737","10.1107/S0108768192004178","","","0.71069","Mo","","","","","","","","","","","","","","","","","has coordinates","208360","2020-10-21","18:00:00",""
"2100858","3.9998","0.0008","3.9998","0.0008","4.018","0.0008","90","","90","","90","","64.28","0.02","","","","","","","","","heated to 1323K and cooled by approximately 15 K h -1","","synthetic, from a mixture of KF:KMoO4:BaTiO3","3","P 4 m m","P 4 -2","","","","","- Ba O3 Ti -","- Ba O3 Ti -","- Ba O3 Ti -","1","0.125","AS0598","Buttner, R. H.; Maslen, E. N.","Structural parameters and electron difference density in BaTiO~3~","Acta Crystallographica Section B","1992","48","6","764","769","10.1107/S010876819200510X","","","0.71069","Mo","","0.013","","","0.013","","","","","","","","","","","","has coordinates","212009","2020-10-21","18:00:00",""
"2100859","3.9998","0.0008","3.9998","0.0008","4.018","0.0008","90","","90","","90","","64.28","0.02","","","","","","","","","heated to 1323K and cooled by approximately 15 K h -1","","synthetic, from a mixture of KF:KMoO4:BaTiO3","3","P 4 m m","P 4 -2","","","","","- Ba O3 Ti -","- Ba O3 Ti -","- Ba O3 Ti -","1","0.125","AS0598","Buttner, R. H.; Maslen, E. N.","Structural parameters and electron difference density in BaTiO~3~","Acta Crystallographica Section B","1992","48","6","764","769","10.1107/S010876819200510X","","","0.71069","Mo","","0.013","","","0.013","","","","","","","","","","","","has coordinates","212009","2020-10-21","18:00:00",""
"2100860","3.9998","0.0008","3.9998","0.0008","4.018","0.0008","90","","90","","90","","64.28","0.02","","","","","","","","","heated to 1323K and cooled by approximately 15 K h -1","","synthetic, from a mixture of KF:KMoO4:BaTiO3","3","P 4/m m m","-P 4 2","","","","","- Ba O3 Ti -","- Ba O3 Ti -","- Ba O3 Ti -","1","0.0625","AS0598","Buttner, R. H.; Maslen, E. N.","Structural parameters and electron difference density in BaTiO~3~","Acta Crystallographica Section B","1992","48","6","764","769","10.1107/S010876819200510X","","","0.71069","Mo","","0.013","","","0.013","","","","","","","","","","2100858","","has coordinates","215354","2020-10-21","18:00:00",""
"2100862","4.006","0.002","4.006","0.002","4.006","0.002","90","","90","","90","","64.29","0.06","","","","","","","","","heated to 1323K and cooled by approximately 15 K h -1","","synthetic, from a mixture of KF:KMoO4:BaTiO3","3","P m -3 m","-P 4 2 3","","","","","- Ba O3 Ti -","- Ba O3 Ti -","- Ba O3 Ti -","1","0.0208333","AS0598","Buttner, R. H.; Maslen, E. N.","Structural parameters and electron difference density in BaTiO~3~","Acta Crystallographica Section B","1992","48","6","764","769","10.1107/S010876819200510X","","","0.71069","Mo","","0.012","","","0.013","","","","","","","","","","2100858","","has coordinates","215354","2020-10-21","18:00:00",""
"2100864","10.804","0.003","13.007","0.004","10.381","0.002","90","","90","","90","","1458.8","0.7","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C6 H2 F2 N2 O4 -","- C6 H2 F2 N2 O4 -","- C48 H16 F16 N16 O32 -","8","1","AS0604","Kubota, M.; Ohba, S.","Electron-density distribution in fluorobenzene derivatives","Acta Crystallographica Section B","1992","48","6","849","854","10.1107/S0108768192006062","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100865","26.733","0.005","6.2947","0.0009","3.7257","0.0006","90","","94.88","0.02","90","","624.67","0.18","","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C7 H5 F O2 -","- C7 H5 F O2 -","- C28 H20 F4 O8 -","4","1","AS0604","Kubota, M.; Ohba, S.","Electron-density distribution in fluorobenzene derivatives","Acta Crystallographica Section B","1992","48","6","849","854","10.1107/S0108768192006062","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278324","2022-10-03","14:41:54",""
"2100866","9.584","0.002","7.601","0.003","8.903","0.002","90","","92.67","0.03","90","","647.9","0.3","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","","","","","- C7 H6 F N O -","- C7 H6 F N O -","- C28 H24 F4 N4 O4 -","4","1","AS0604","Kubota, M.; Ohba, S.","Electron-density distribution in fluorobenzene derivatives","Acta Crystallographica Section B","1992","48","6","849","854","10.1107/S0108768192006062","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100867","14.608","0.005","15.757","0.006","5.303","0.002","90","","90","","90","","1220.6","0.8","","","","","","","","","","","","5","P b c a","-P 2ac 2ab","","","","","- C6 H5 Cl F N -","- C6 H5 Cl F N -","- C48 H40 Cl8 F8 N8 -","8","1","AS0604","Kubota, M.; Ohba, S.","Electron-density distribution in fluorobenzene derivatives","Acta Crystallographica Section B","1992","48","6","849","854","10.1107/S0108768192006062","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100868","14.582","0.001","12.321","0.001","12.363","0.001","90","","90","","90","","2221.2","0.3","","","","","","","","","","","","5","P n m a","-P 2ac 2n","62","","","","- Al61 Cr17 Cu7 Fe11 Si3 -","- Al23 Cr10 Cu6 -","- Al92 Cr40 Cu24 -","4","0.5","CR0395","Kang, S. S.; Malaman, B.; Venturini, G.; Dubois, J. M.","Structure of the quasicystal-approximant phase Al~61.3~Cu~7.4~Fe~11.1~Cr~17.2~Si~3~","Acta Crystallographica Section B","1992","48","6","770","776","10.1107/S0108768192005226","","","0.71073","Mo","","","","","","","","","","","","","","","","","has coordinates","278244","2022-09-28","13:56:22",""
"2100869","33.96","0.01","15.795","0.005","10.879","0.002","90","","90","","90","","5835","3","","","","","","","","","","","","5","F d d 2","","","","","","- C13 H14 Cl2 N2 O -","- C13 H14 Cl2 N2 O -","- C208 H224 Cl32 N32 O16 -","16","1","CR0416","Ammon, H. L.; Bashir-Hashemi, A.","Structures of secocubane and nortwistbrendane derivatives","Acta Crystallographica Section B","1992","48","6","832","837","10.1107/S0108768192005238","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2100870","9.902","0.002","9.381","0.002","15.174","0.002","90","","103.25","0.01","90","","1372","0.4","","","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C13 H15 Cl2 N O3 -","- C13 H15 Cl2 N O3 -","- C52 H60 Cl8 N4 O12 -","4","1","CR0416","Ammon, H. L.; Bashir-Hashemi, A.","Structures of secocubane and nortwistbrendane derivatives","Acta Crystallographica Section B","1992","48","6","832","837","10.1107/S0108768192005238","","","1.5418","Cu","","","","","","","","","","","","","","","","","has coordinates","208452","2020-10-21","18:00:00",""
"2100871","7.29","0.003","14.817","0.007","18.52","0.004","90","","90","","90.35","0.05","2000.4","1.3","","","","","","","","","","","","3","P 1 1 21","P 2c","4","","","","- C46 H66 O8 -","- C46 H66 O8 -","- C92 H132 O16 -","2","1","GE0311","Kálmán, A.; Argay, G.; Zivanov-Stakić, D.; Vladimirov, S.; Ribár, B.","Novel observations on the `main-part' isostructuralism exhibited by various steroid molecules: structures of 5-androstene-3β,17β-diol monohydrate and a 1:2 adduct of digitoxigenin and digirezigenin","Acta Crystallographica Section B","1992","48","6","812","819","10.1107/S010876819200449X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","205902","2020-10-21","18:00:00",""
"2100872","6.25","0.001","12.143","0.001","23.44","0.002","90","","90","","90","","1778.9","0.4","","","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","","","","","- C19 H32 O3 -","- C19 H31 O3 -","- C76 H124 O12 -","4","1","GE0311","Kálmán, A.; Argay, G.; Zivanov-Stakić, D.; Vladimirov, S.; Ribár, B.","Novel observations on the `main-part' isostructuralism exhibited by various steroid molecules: structures of 5-androstene-3β,17β-diol monohydrate and a 1:2 adduct of digitoxigenin and digirezigenin","Acta Crystallographica Section B","1992","48","6","812","819","10.1107/S010876819200449X","","","1.54184","Cu","","","","","","","","","","","","","","","","","has coordinates","176768","2020-10-21","18:00:00",""
"2100873","10.989","0.002","7.847","0.002","25.833","0.004","90","","103.61","0.02","90","","2165","0.8","","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","","","","","- C14 H15 N -","- C14 H15 N -","- C112 H120 N8 -","8","2","GR0192","Wingert, L. M.; Staley, S. W.","Molecular structure and crystal packing of 6-(<i>p</i>-dimethylaminophenyl)fulvene","Acta Crystallographica Section B","1992","48","6","782","789","10.1107/S0108768192000971","","","0.7107","Mo","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2105430","12.134","","12.134","","12.134","","90","","90","","90","","1786.54","","","","","","","","","","","","","4","F -4 3 c","F -4a 2 3","219","","Cr3 (B7 O13 Br)","","- B7 Br Cr3 O13 -","- B7 Br Cr3 O13 -","- B56 Br8 Cr24 O104 -","8","0.0833333","","Yvon, K.; Yoshida, M.; Schmid, H.; Kubel, F.","Cubic structure of chromium-bromine boracite at 298 and 113 K","Acta Crystallographica B (39,1983-)","1992","48","","30","32","","","","","","","","","","","","","","","","","","","","","","has coordinates","176435","2020-10-21","18:00:00",""
"2107236","3.847","","3.875","","11.7","","90","","90","","90","","174.413","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Y Ba2 Cu3 O6.54","","- Ba2 Cu3 O6.54 Y -","- Ba2 Cu3 O6.54 Y -","- Ba2 Cu3 O6.54 Y -","1","0.125","","Buttner, R.H.; Maslen, E.N.; Spadaccini, N.","A position-space model for superconductivity in YBa2Cu3O7-x","Acta Crystallographica B (39,1983-)","1992","48","","21","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107237","3.842","","3.886","","11.69","","90","","90","","90","","174.532","","","","","","","","","","","","","4","P m m m","-P 2 2","47","","Y Ba2 Cu3 O6.78","","- Ba2 Cu3 O6.78 Y -","- Ba2 Cu3 O6.78 Y -","- Ba2 Cu3 O6.78 Y -","1","0.125","","Buttner, R.H.; Maslen, E.N.; Spadaccini, N.","A position-space model for superconductivity in Y Ba2 Cu3 O7-x","Acta Crystallographica B (39,1983-)","1992","48","","21","30","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107264","7.278","","8.856","","6.858","","90","","115.75","","90","","398.131","","","","","","","","","","","","","4","P 1 21/a 1","-P 2yab","14","","Ca Ti (Si O4) O","","- Ca O5 Si Ti -","- Ca O5 Si Ti -","- Ca4 O20 Si4 Ti4 -","4","1","","Kunz, M.; Armbruster, T.","Applications and limitations of the ionic potential model with empirically derived ion-specific repulsion parameters","Acta Crystallographica B (39,1983-)","1992","48","","609","622","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107265","8.642","","8.642","","5.63","","90","","90","","90","","420.472","","","","","","","","","","","","","4","P 4 b m","P 4 -2ab","100","","Ba2 (Ti O) (Si2 O7)","","- Ba2 O8 Si2 Ti -","- Ba2 O8 Si2 Ti -","- Ba4 O16 Si4 Ti2 -","2","0.25","","Kunz, M.; Armbruster, T.","Applications and limitations of the ionic potential model with empirically derived ion-specific repulsion parameters","Acta Crystallographica B (39,1983-)","1992","48","","609","622","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"2107326","10.474","","10.474","","7.443","","90","","90","","120","","707.137","","","","","","","","","","","","","3","P 31","P 31","144","","Rb (N O3)","","- N O3 Rb -","- N O3 Rb -","- N9 O27 Rb9 -","9","3","","Pohl, J.; Pohl, D.; Adiwidjaja, G.","Phase transition in rubidium nitrate at 346 K and structure at 296, 372, 413 and 437 K","Acta Crystallographica B (39,1983-)","1992","48","","160","166","","","","","","","","","","","","","","","","","","","","","","has coordinates","176429","2020-10-21","18:00:00",""
"6000576","7.1743","","7.0967","","8.8323","","90","","90","","90","","449.69","","","","","","","","","","","","","4","P b m a","","","","","","- C D6 I N -","","","","","","Yamamuro, O.; Matsuo, T.; Suga, H.; David, W. I. F.; Ibberson, R. M.; Leadbetter, A. J.","Neutron-diffraction and calorimetric studies of methylammonium iodide","Acta Crystallographica B","1992","48","3","329","336","10.1107/S0108768192000260","","","","","","","","","","","","","","","","","","","","","","188606","2020-10-21","18:00:00",""