# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2025-12-09T02:47:28+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 C: Crystal Structure Communications') AND volume = 51 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
"2000008","8.2513","0.0008","10.5006","0.0013","9.309","0.0008","90","","102.849","0.011","90","","786.369","","","","","","","","","","","","","4","P 1 21 1","P 2yb","4","(-)-(SS)-alpha-Phenyl-2-(p-Tolylsulfinyl)-3-furanmethanol","","","- C18 H16 O3 S -","- C18 H16 O3 S -","- C36 H32 O6 S2 -","2","1","","Retoux, R.; Girodier, L.; Rouessac, F.","(-)-(S,S)-α-Phenyl-2-(p-tolylsulfinyl)-3-furanmethanol","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","146","148","10.1107/s0108270194006050","","","","","","","0.0329","","","0.0329","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2000012","7.968","0.0014","8.1104","0.0011","23.761","0.003","90","","90","","90","","1535.52","","","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H20 O3 S -","- C16 H20 O3 S -","- C64 H80 O12 S4 -","4","1","","Retoux, R.; Hayes, P.; Maignan, C.","(5S,SS)-7-Methyl-8-p-toluenesulfinyl-1,6-dioxaspiro[4.5]dec-7-ene","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","93","94","10.1107/s0108270194007298","","","","","","","0.0514","","","0.0514","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2000013","8.5143","0.0007","11.8171","0.0006","14.752","0.0009","90","","90","","90","","1484.26","","","","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H17 N O3 S -","- C16 H17 N O3 S -","- C64 H68 N4 O12 S4 -","4","1","","Gosselin, P.; Bonfand, E.; Maignan, C.; Retoux, R.","The Diels-Alder Adduct of an Enantiopure 2-Sulfinyldiene and Maleimide: (1S,2R,3S,SR)-3-Methyl-5-p-toluenesulfinylcyclohex-4-en-1,2-dicarboximide","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","94","","10.1107/s0108270194007304","","","","","","","0.0419","","","0.0419","","","","","","","","","","","has coordinates","199648","2020-10-21","18:00:00",""
"2002902","18.0105","0.0012","4.2413","0.0003","30.66","0.002","90","","93.297","0.005","90","","2338.2","0.3","150","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H42 S3 -","- C21 H42 S3 -","- C84 H168 S12 -","4","2","","Veldman, Nora; Spek, Anthony L.; Edema, Jilles J. H.; Kellogg, Richard M.","2,4,6-Trihexyl-1,3,5-trithiane","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","88","91","10.1107/s0108270194008115","","","0.71073","MoKα","","","0.0694","","0.1768","0.1286","","","","0.921","1.143","1.143","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2002903","13.044","0.003","6.847","0.002","9.465","0.004","90","","98.46","0.03","90","","836.1","0.5","294","2","","","","","","","","","","4","P 1 2/c 1","-P 2yc","13","","","","- C7 H13 N O2 -","- C7 H13 N O2 -","- C28 H52 N4 O8 -","4","1","","Larsen, Ingrid Kjoller; Trickey, Peter","Cyclohexanecarbohydroxamic Acid","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","125","127","10.1107/S0108270194008413","","","0.71073","MoKα","","","0.0546","","0.2005","0.1446","","","","0.94","0.97","0.97","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2002904","8.677","0.002","9.438","0.002","13.504","0.003","90","","96.45","0.03","90","","1098.9","0.4","130","2","","","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C10 H10 Br Cl O2 -","- C10 H10 Br Cl O2 -","- C40 H40 Br4 Cl4 O8 -","4","2","","Shaw, Joanne P.; Tan, Eng Wui; Blackman, Allan G.","Homochiral Methyl (2R,3S)-2-Chloro-3-bromo-3-phenylpropanoate","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","134","135","10.1107/S0108270194008218","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:21",""
"2002905","15.783","0.002","5.458","0.001","9.586","0.001","90","","104.97","0.01","90","","797.7","0.2","173","1","","","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C7 H12 O4 -","- C7 H12 O4 -","- C28 H48 O16 -","4","1","","Kopf, Jürgen; Schulz, Stefan","(1'R,2S,3R)-2-Hydroxy-2-(1-hydroxyethyl)-3-methyl-γ-butyrolactone","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","84","86","10.1107/s010827019400819x","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2002941","4.6","0.003","10.041","0.001","24.835","0.0003","90","","90","","90","","1147.1","0.8","123","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C11 H17 N3 O4 -","- C11 H17 N3 O4 -","- C44 H68 N12 O16 -","4","1","","Napper, Scott; Stuart, Allan L.; Kumar, Sashi V. P.; Gupta, V. Sagar; Delbaere, Louis T. J.","5-Ethyl-2'-deoxycytidine, C~11~H~17~N~3~O~4~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","96","98","10.1107/s0108270194005330","","","0.7093","MolybdenumKα","","","","","","","","","","","","","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2003167","8.2116","0.0007","11.229","0.001","7.5178","0.0009","108.507","0.008","113.336","0.007","73.187","0.007","592.9","0.1","294","","294","","","","","","","","","4","P -1","-P 1","2","Vanadyl bis(acetylacetonate)","Bis(2,4-pentanedionato)oxovanadium(IV)","","- C10 H14 O5 V -","- C10 H14 O5 V -","- C20 H28 O10 V2 -","2","1","FG1025","Shuter, Edward; Rettig, Steven J.; Orvig, Chris","Bis(2,4-pentanedionato)oxovanadium(IV), a Redetermination","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","12","14","10.1107/S0108270194010462","","","0.7107","MoKα","","0.149","0.037","","0.041","0.035","","","","","1.87","1.87","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003168","10.563","0.002","10.603","0.003","12.25","0.003","97.68","0.04","99.34","0.03","93.11","0.02","1337.6","0.5","293","","","","","","","","","","","8","P 1","P 1","1","","","","- C48 H38 Cl4 F6 Mn N5 O5 P6 -","- C48 H38 Cl4 F6 Mn N5 O5 P6 -","- C48 H38 Cl4 F6 Mn N5 O5 P6 -","1","1","","Carriedo, Gabino A.; Fernández, Lucia; Gómez, Paloma; Garcia-Granda, Santiago; Velázquez, Amador Menéndez","cis-trans-[{N~3~P~3~Cl~4~(C~6~H~5~)(PPh~2~)}Mn(CO)~2~(bipy) {P(OPh)~3~}]PF~6~. A Cationic Manganese‒Carbonyl Complex with a Phosphazenylphosphine Ligand","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","20","23","10.1107/s0108270194006943","","","0.71073","MoKα","","","0.0442","","0.1144","0.1082","","","","0.957","1.112","1.112","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2003169","12.674","0.003","20.023","0.004","11.494","0.003","90","","96.11","0.02","90","","2900.3","1.2","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","31-phenyl-13,16,19,22,25-pentoxa-2,6,31-diazaphosphatetracyclo [24,4,0,1^2,6^,0^7,12^]hentriaconta-1(26),7,9,11,27,29-hexene-31-sulfide","","- C29 H35 N2 O5 P S -","- C29 H35 N2 O5 P S -","- C116 H140 N8 O20 P4 S4 -","4","1","HU1098","Van Oostenryck, Luc; Tinant, Bernard; Declercq, Jean-Paul; Dutasta, Jean-Pierre","A Macrobicyclic Thiophosphonamide Polyether Ligand","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","80","84","10.1107/S0108270194003914","","","0.71069","MolybdenumKα","","0.0671","0.0487","","0.1386","0.1306","","","","1.061","1.176","1.176","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003170","16.791","0.012","15.927","0.011","10.922","0.006","90","","100.31","0.05","90","","2873.7","3.3","293","2","293","2","","","","","","","","6","P 1 21/n 1","-P 2yn","14","","31-phenyl-13,16,19,22,25-pentoxa-2,6,31-diazaphosphatetracyclo [24,4,0,1^2,6^,0^7,12^]hentriaconta-1(26),7,9,11,27,29-hexene-31-sulfide","","- C29 H35 N2 O5 P S -","- C32 N2 O6 P S -","- C128 N8 O24 P4 S4 -","4","1","HU1098","Van Oostenryck, Luc; Tinant, Bernard; Declercq, Jean-Paul; Dutasta, Jean-Pierre","A Macrobicyclic Thiophosphonamide Polyether Ligand","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","80","84","10.1107/S0108270194003914","","","0.71069","MolybdenumKα","","0.086","0.056","","0.1607","0.1511","","","","1.063","1.19","1.19","","","","","has coordinates","269316","2021-09-26","23:26:48",""
"2003172","16.15","0.006","16.842","0.009","19.599","0.007","69.02","0.05","80.85","0.04","70.91","0.06","4698","","293","","","","","","","","","","","3","P -1","-P 1","2","","","","- C54 H54 O12 -","- C54 H54 O12 -","- C216 H216 O48 -","4","2","PA1110","Khrifi, Saad; Guelzim, Abdelhalim; Baert, Francois; Mussrabi, Mamoun; Asfari, Zouhair; Vicens, Jacques","7,15,23-Triphenyl-25,26,27-triethylester-2,3,10,11,18,19-hexahomo-3,9,11-trioxacalix[3]arene in a Partial-Cone Conformation","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","153","157","10.1107/s0108270194008036","","","0.71063","MoKα","","","0.059","","","0.059","","","","","","","","","","","has coordinates","303005","2025-10-27","14:04:45",""
"2003176","8.989","0.003","9.6878","0.0011","41.67","0.004","90","","90","","90","","3628.8","1.3","293","2","","","","","","","","","","4","P b c a","-P 2ac 2ab","61","","","","- C22 H21 N3 O -","- C22 H21 N3 O -","- C176 H168 N24 O8 -","8","1","","Olszewski, Piotr K.; Stadnicka, Katarzyna","Two Centrosymmetric Conjugated Nitrones of the Diazabutadiene System","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","98","103","10.1107/S0108270194007742","","","1.54056","CuKα~1~","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003178","8.5143","0.0007","11.8171","0.0006","14.752","0.0009","90","","90","","90","","1484.3","0.2","293","2","","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C16 H17 N O3 S -","- C16 H17 N O3 S -","- C64 H68 N4 O12 S4 -","4","1","","Gosselin, P.; Bonfand, E.; Maignan, C.; Retoux, R.","The Diels-Alder Adduct of an Enantiopure 2-Sulfinyldiene and Maleimide: (1S,2R,3S,R~s~)-3-Methyl-5-p-toluenesulfinylcyclohex-4-en-1,2-dicarboximide","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","94","96","10.1107/S0108270194007304","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2003179","5.607","0.002","10.954","0.003","27.452","0.015","90","","90","","90","","1686.1","1.1","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H20 N2 O3 -","- C20 H20 N2 O3 -","- C80 H80 N8 O12 -","4","1","","Chiaroni, Angèle; Deyine, Abdallah; Griffard-Brunet, Dominique; Langlois, Nicole; Riche, Claude","(3aS,3bR,6R,7aR)-2-Benzyl-1,2,3a,3b,4,7a-hexahydro-6-phenyl-3,5-dioxa- 2,6a-diazacyclopenta[a]pentalen-7-one","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","91","93","10.1107/S0108270194007316","","","1.5418","CuKα","","","0.037","","","0.052","","","","","1.04","1.04","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2003181","16.492","0.004","9.483","0.003","7.025","0.002","90","0.02","90","0.02","90","0.02","1098.7","0.5","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H15 N O2 -","- C13 H15 N O2 -","- C52 H60 N4 O8 -","4","1","","Luger, Peter; Weber, Manuela; Dung, Nguyen Xuan; Ky, Pham Thanh; Long, Phan Ke","Securinine, an Alkaloid from Fluggea virosa","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","127","129","10.1107/S0108270194007857","","","1.5418","CuKα","","","0.036","","0.029","0.026","","","","1.604","1.717","1.717","","","","","has coordinates","200786","2020-10-21","18:00:00",""
"2003183","8.785","0.002","11.233","0.002","14.555","0.003","72.47","0.01","84.54","0.01","69.54","0.01","1283.1","0.5","153","1","","","","","","","","","","6","P -1","-P 1","2","","","","- C26 H22 N4 O7 Pd S -","- C28 H16 N4 O8 Pd S2 -","- C56 H32 N8 O16 Pd2 S4 -","2","1","","Törnroos, Karl W.","A Dinitrato(diphenylphenanthroline)palladium(II) Complex","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","238","242","10.1107/S0108270194008887","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003184","9.325","0.001","11.474","0.002","17.418","0.003","90","","90","","90","","1863.6","0.5","293","2","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H26 N2 O4 -","- C21 H26 N2 O4 -","- C84 H104 N8 O16 -","4","1","","Lewinski, Krzysztof; Nitek, Wojciech; Oleksyn, Barbara J.; Stec, Boguslaw","Quitenine Ethyl Ester","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","282","285","10.1107/S0108270194010243","","","1.54178","CuKα","","","0.0335","","0.0946","0.0914","","","","1.029","1.045","1.045","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003185","9.685","0.003","7.128","0.002","13.572","0.004","90","","99.78","0.02","90","","923.3","0.5","293","2","","","","","","","","","","5","P 1 21/a 1","-P 2yab","14","","","","- C7 H9 F3 N2 O2 -","- C7 H9 F3 N2 O2 -","- C28 H36 F12 N8 O8 -","4","1","","Tinant, Bernard; Declercq, Jean-Paul; Bouillon, Jean-Philippe","Oxime of 1-Methyl-3-trifluoroacetylpyrrolidin-2-one","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","270","272","10.1107/S0108270194010930","","","0.71069","MoKα","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003186","8.189","0.003","5.047","0.001","11.305","0.005","90","","96.12","0.02","90","","464.6","0.5","293","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C7 H13 N3 O3 -","- C7 H13 N3 O3 -","- C14 H26 N6 O6 -","2","1","AS1117","Puliti, Raffaella; Mattia, Carlo Andrea","N-Acetylglycyl-L-alaninamide and N-Acetyl-L-alanyl-L-alaninamide","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","336","339","10.1107/s0108270194008577","","","1.54056","CuKα","","","0.03","","","0.033","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003187","5.5005","0.0004","9.429","0.001","20.712","0.002","90","","90","","90","","1074.2","0.3","293","","","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C8 H15 N3 O3 -","- C8 H15 N3 O3 -","- C32 H60 N12 O12 -","4","1","AS1117","Puliti, Raffaella; Mattia, Carlo Andrea","N-Acetylglycyl-L-alaninamide and N-Acetyl-L-alanyl-L-alaninamide","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","336","339","10.1107/s0108270194008577","","","1.54056","CuKα","","","0.036","","","0.04","","","","","0.97","0.97","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003188","10.3118","0.0007","11.5912","0.0006","7.1818","0.0006","90","","90","","90","","858.41","0.08","293","","20","","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","","","","- C6 H12 Cl N O3 -","- C6 H11 Cl N O3 -","- C24 H44 Cl4 N4 O12 -","4","1","AS1139","Jones, Graham P.; Paleg, Leslie G.; Waisel, Yoav; Solomon, Aaron; Beer, Sven; Tiekink, Edward R. T.","trans-3-Hydroxy-N-methyl-L-proline Hydrochloride","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","287","289","10.1107/S0108270194009431","","","1.5418","CuKα","","","0.05","","","0.059","","","","","4.25","4.25","","","","","has coordinates","209634","2020-10-21","18:00:00",""
"2003189","9.347","0.008","4.772","0.007","12.967","0.005","90","","90.49","0.05","90","","578.3","0.8","23","","","","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C9 H16 N4 O5 -","- C9 H16 N4 O5 -","- C18 H32 N8 O10 -","2","1","","Delaere, Ian M.; Tate, Max E.; Jones, Graham P.; Tiekink, Edward R. T.","N-γ-L-Glutamyl-β-cyano-L-alanine, an Antinutritional Factor ex Vicia sativa L., as its Ammonium Salt","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","289","291","10.1107/S0108270194009443","","","0.7107","MoKα","","","","","","","","","","","","","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003190","20.503","0.003","13.436","0.002","22.916","0.004","90","","112.357","0.014","90","","5838.3","1.6","295","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- C30 H39 Cl Sn -","- C30 H39 Cl Sn -","- C240 H312 Cl8 Sn8 -","8","1","BK1044","Wharf, I.; Simard, M. G.; McGinn, K.","Tris(4-tert-butylphenyl)chlorotin(IV)","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","236","238","10.1107/S010827019400987X","","","1.5418","CuKα","","","0.051","","","0.054","","","","","2.94","2.94","","","","","has coordinates","209641","2020-10-21","18:00:00",""
"2003191","9.415","0.002","11.539","0.003","13.388","0.002","72.18","0.01","79.37","0.01","76.9","0.03","1338.2","0.5","294","","294","","","","","","","","","6","P -1","-P 1","2","","(η^5^-Cyclopentadienyl)[η^2^-diphenyl(o-phenylene)methyl] oxo(trimethylsilylmethylthio)tungsten(VI)","","- C29 H32 O S Si W -","- C29 H32 O S Si W -","- C58 H64 O2 S2 Si2 W2 -","2","1","BK1047","Brunet, Nathalie; Legzdins, Peter; Trotter, James; Yee, Vivien C.","(η5-Cyclopentadienyl)[2-(1,1-diphenylethyl-C^2^)phenyl-C^1^]oxo (trimethylsilylmethylthio)tungsten, [WO(C~4~H~11~SSi)(C~5~H~5~)(C~20~H~16~)]","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","193","195","10.1107/S0108270194007079","","","0.7093","MolybdenumKα~1~","","0.04","0.027","","0.032","0.032","","","","","1.25","1.25","","","","","has coordinates","190981","2020-10-21","18:00:00",""
"2003192","7.889","0.001","19.49","0.003","8.559","0.001","90","","101.7","0.01","90","","1288.7","0.6","295","","","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C14 H22 O3 -","- C14 H22 O3 -","- C56 H88 O12 -","4","1","","Park, Kwangyong; Swenson, Dale C.; Scott, William J.; Wiemer, David F.","(1β,5α,6β)-10,10-(1,2-Ethylenedioxy)-1,5-di-methylbicyclo [4.4.0]decan-4-one","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","268","270","10.1107/S0108270194008759","","","0.71073","MoKα","","","0.046","","","0.072","","","","","1.43","1.43","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003193","26.377","0.004","8.297","0.002","9.994","0.002","90","","90","","90","","2187.2","0.8","298","","","","","","","","","","","4","P b c a","","","","","","- C9 H15 O5 P -","- C9 H15 O5 P -","- C72 H120 O40 P8 -","8","1","","Lane, Thomas M.; Rodriguez, Oscar P.; Sommese, Anthony G.; Cremer, Sheldon E.; Bennett, Dennis W.","cis-6-Methoxycarbonyl-2,10-dioxa-1-phosphabicyclo[4.4.0]decane 1-Oxide","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","251","253","10.1107/S0108270194008607","","","0.71069","MoKα","","","0.034","","","0.055","","","","","2.55","2.55","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003195","10.0416","0.0004","8.0285","0.0003","4.8553","0.0002","90","","90","","90","","391.43","0.04","298","2","","","","","","","","","","5","P n a 21","P 2c -2n","33","","","","- As Be H2 Li O5 -","- As Be H2 Li O5 -","- As4 Be4 H8 Li4 O20 -","4","1","","Harrison, William T. A.; Gier, Thurman E.; Stucky, Galen D.","Lithium Berylloarsenate Hydrate, LiBeAsO~4~.H~2~O","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","181","183","10.1107/S0108270194010061","","","1.54178","CopperKα","","","","","","","","","","","","","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003196","10.026","0.004","9.23","0.003","16.943","0.007","90","","97.3","0.03","90","","1555.2","1","173","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C17 H17 N5 O -","- C17 H17 N5 O -","- C68 H68 N20 O4 -","4","1","","Lynch, Vincent M.; Hulme, Christopher; Magnus, Philip; Davis, Brian E.","Novel N-Acyl α-Azidopyrrolidines (N-Acyliminium-Ion Precursors)","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","262","265","10.1107/S0108270194005676","","","0.71073","MoKα","","","0.0489","","0.0575","0.0499","","","","","1.329","1.329","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003197","10.198","0.002","18.087","0.003","10.232","0.002","90","","119.77","0.01","90","","1638.2","0.6","173","1","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H17 N7 O4 -","- C14 H17 N7 O4 -","- C56 H68 N28 O16 -","4","1","","Lynch, Vincent M.; Hulme, Christopher; Magnus, Philip; Davis, Brian E.","Novel N-Acyl α-Azidopyrrolidines (N-Acyliminium-Ion Precursors)","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","262","265","10.1107/S0108270194005676","","","0.71073","MoKα","","","0.04","","0.0473","0.0411","","","","","1.213","1.213","","","","","has coordinates","208377","2020-10-21","18:00:00",""
"2003199","5.166","0.002","20.282","0.002","15.513","0.003","90","","96.41","0.03","90","","1615.2","0.5","294","","","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H16 O7 -","- C20 H16 O7 -","- C80 H64 O28 -","4","2","","Chan, Simon; Trotter, James","Aversin","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","272","274","10.1107/S0108270194010589","","","1.5418","CuKα","","","0.063","","0.085","0.079","","","","","1.47","1.47","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003200","4.533","0.001","16.537","0.003","12.687","0.003","90","","97.22","0.03","90","","943.5","0.3","569","2","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C13 H9 N O -","- C13 H9 N O -","- C52 H36 N4 O4 -","4","1","","Potts, Graham D.; Jones, William","9(10H)-Acridone","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","267","268","10.1107/S0108270194008565","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003203","9.446","0.001","10.817","0.003","15.1","0.002","90","","101.16","0.01","90","","1513.7","0.5","247","","","","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H20 N2 O4 -","- C14 H20 N2 O4 -","- C56 H80 N8 O16 -","4","1","","Numan, Milco; Schenk, Henk; Döpp, Dietrich","1,5-Di-tert-butyl-2,4-dinitrobenzene, C~14~H~20~N~2~O~4~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","260","262","10.1107/S010827019400836X","","","1.5418","CuKα","","","0.07","","","0.087","","","","","0.235","0.235","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003204","11.453","0.002","12.119","0.002","17.444","0.004","90","","90","","90","","2421.2","0.8","295","2","","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","","","- C12 H10 Cd N2 O5 -","- C12 H10 Cd N2 O5 -","- C96 H80 Cd8 N16 O40 -","8","1","","Clegg, William; Cressey, Jonathan T.; McCamley, Andrew; Straughan, Brian P.","The Polymeric Structure of Aquacadmium Bisnicotinate","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","234","235","10.1107/S0108270194007249","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","209447","2020-10-21","18:00:00",""
"2003208","9.958","0.003","9.961","0.004","12.978","0.006","90","0.03","90","0.03","90","0.03","1287.3","0.9","294","2","","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H24 O -","- C15 H24 O -","- C60 H96 O4 -","4","1","","Mukherjee, Monika; Mukherjee, Alok K.; Das, Sarbani; Mukherjee, Debabrata; Helliwell, Madeleine","(±)-7,7,9β-Trimethyl-6(αH)-cis-tricyclo[6.3.1.0^1,6^]dodecan-2-one","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","280","282","10.1107/S0108270194008632","","","1.5418","CuKα","","","0.0502","","0.1312","0.1217","","","","0.874","0.841","0.841","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003209","8.582","0.002","8.996","0.002","15.357","0.003","94.9","0.01","93.27","0.01","117.59","0.01","1040","1","293","","","","","","","","","","","4","P -1","-P 1","2","","","","- C24 H27 N3 O3 -","- C24 H27 N3 O3 -","- C48 H54 N6 O6 -","2","1","","Adam, David; McCabe, Peter H.; Sim, George A.; Bouchemma, Ahcene","Conformational Study of 1,3,5-Tris(o-methoxyphenyl)-1,3,5-triazacyclohexane and 1,3,5-Tris(p-methoxyphenyl)-1,3,5-triazacyclohexane","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","246","249","10.1107/S0108270194005846","","","0.71069","MoKα","","","0.038","","","0.05","","","","","2.23","2.23","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003210","15.518","0.002","16.427","0.002","8.46","0.001","90","","90","","90","","2157","2","293","","","","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C24 H27 N3 O3 -","- C24 H27 N3 O3 -","- C96 H108 N12 O12 -","4","1","","Adam, David; McCabe, Peter H.; Sim, George A.; Bouchemma, Ahcene","Conformational Study of 1,3,5-Tris(o-methoxyphenyl)-1,3,5-triazacyclohexane and 1,3,5-Tris(p-methoxyphenyl)-1,3,5-triazacyclohexane","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","246","249","10.1107/S0108270194005846","","","1.5418","CuKα","","","0.027","","","0.036","","","","","1.88","1.88","","","","","has coordinates","301791","2025-08-18","23:15:22",""
"2003212","11.144","0.003","15.667","0.004","13.048","0.005","90","","96.32","0.03","90","","2264.2","1.2","140","2","","","","","","","","","","6","P 1 21/m 1","-P 2yb","11","","","","- C40 H24 Cl2 Ir6 O14 P2 -","- C40 Cl2 Ir6 O14 P2 -","- C80 Cl4 Ir12 O28 P4 -","2","0.5","","Mazzanti, Marinella; Roulet, Raymond; Schenk, Kurt J.","Bis(diphenylphosphino)methanetetradecacarbonylhexairidium Dichloromethane Solvate","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","217","219","10.1107/S010827019400569X","","","0.71073","MoKα","","","","","","","","","","","","","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003213","9.197","0.002","17.323","0.004","25.841","0.007","90","","90","","90","","4117","2","293","2","","","","","","","","","","6","P 21 c n","P -2n 2a","33","","","","- C36 H48 Cl5 N2 P2 Re -","- C39 H37 Cl5 N2 P2 Re -","- C156 H148 Cl20 N8 P8 Re4 -","4","1","","Masciocchi, Norberto; Moret, Massimo; Ardizzoia, G. Attilio; La Monica, Girolamo","[ReCl~3~(C~8~H~11~P)~2~(C~7~H~11~N)~2~].C~6~H~4~Cl~2~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","201","203","10.1107/s0108270194007420","","","0.71073","MoKα","","","0.045","","","0.112","","","","","1.101","1.101","","","","","has coordinates","249493","2020-10-21","18:00:00",""
"2003214","10.3254","0.0003","11.2915","0.0002","25.0237","0.0005","85.981","0.003","80.177","0.003","78.517","0.003","2815.2","0.4","293","","","","","","","","","","","6","P -1","-P 1","2","","","","- C54 H76 Be Cl4 N2 O8 -","- C54 H76 Be Cl4 N2 O8 -","- C108 H152 Be2 Cl8 N4 O16 -","2","1","","Burzlaff, Hans; Lange, Joachim; Spengler, Roland; Karayannis, Miltiadis I.; Veltsistas, Panos G.","Bis(hexadecylpyridinium) Bis(3,6-dichloro-4,5- dihydroxy-3,5-cyclohexadiene-1,2-dionato-κ^2^O^4^,O^5^)]beryllium","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","190","193","10.1107/S0108270194006530","","","0.7107","MoKα1","","","0.068","","","0.032","","","","","1.44","1.44","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003216","6.192","0.004","6.297","0.003","8.106","0.001","96.6","0.008","104.517","0.008","102.864","0.007","293.4","0.2","293","2","293","2","","","","","","","","4","P -1","-P 1","2","","aluminium potassium diarsenate","","- Al As2 K O7 -","- Al As2 K O7 -","- Al2 As4 K2 O14 -","2","1","NA1114","Boughzala, Habib; Jouini, Tahar","KAlAs~2~O~7~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","179","181","10.1107/S0108270194010395","","","0.71069","MoKα","","0.0353","0.0331","","0.0902","0.0879","","","","0.537","0.555","0.555","","","","","has coordinates","249494","2020-10-21","18:00:00",""
"2003218","17.383","0.003","9.538","0.001","20.056","0.003","90","","102.6","0.01","90","","3245.2","0.8","173","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C27 H51 O10 P3 -","- C27 H51 O10 P3 -","- C108 H204 O40 P12 -","4","1","","Ramm, Matthias; Costisella, Burkhard; Gross, Hans","Hexaethyl (3,5-Di-tert-butyl-4-hydroxyphenyl)methanetrisphosphonate at 173 K","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","274","277","10.1107/S0108270194009376","","","1.54178","CuKα","","","","","","","","","","","","","","","","","has coordinates","200787","2020-10-21","18:00:00",""
"2003437","14.883","0.003","12.447","0.004","12.56","0.003","90","","90","","90","","2327","1","293","","","","","","","","","","?","2","P n m a","-P 2ac 2n","62","","","","- Al10 Mn3 -","- Al10.01 Mn2.99 -","- Al120.12 Mn35.88 -","12","1.5","","Pavlyuk, Volodymyr V.; Yanson, Tamara I.; Bodak, Oksana I.; Černý, Radovan; Gladyshevskii, Roman E.; Yvon, Klaus; Stepien-Damm, Julia","Structure Refinement of Orthorhombic MnAl~3~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","5","792","794","10.1107/s0108270194012965","","","0.71073","MoKα","","","0.045","","","0.025","","","","","1.316","1.316","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2003785","7.214","0.001","10.513","0.001","19.459","0.002","90","","90.81","0.01","90","","1475.7","0.5","293","","","","","","","","","","slow evaporation","5","P 1 21 1","P 2yb","4","","","","- C13 H16 N4 O3 S -","- C13 H16 N4 O3 S -","- C52 H64 N16 O12 S4 -","4","2","","Tsiveriotis, P.; Hadjiliadis, N.; Dahan, F.; Laussac, J. P.","Methyl 4-Diethylamino-2-formamidothieno[2,3-d]pyrimidine-6-carboxylate","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","8","1607","1609","10.1107/S0108270194012692","","","0.71073","MoKα","","","0.021","","","0.025","","","","","0.85","0.85","","","","","has coordinates","301791","2025-08-18","23:15:25",""
"2003932","22.935","0.003","8.746","0.001","11.702","0.001","90","","95.66","0.01","90","","2335.9","0.5","298","","","","","","","","","","see text","5","P 1 21/c 1","-P 2ybc","14","","","","- C18 H21 Ca N5 O13 -","- C18 H21 Ca N5 O13 -","- C72 H84 Ca4 N20 O52 -","4","1","NA1155","Hundal (née Sood), G.; Martínez-Ripoll, M.; Hundal, M. S.; Poonia, N. S.","Bis(2,4-dinitrophenolato)(triethanolamine)calcium(II)","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","9","1788","1791","10.1107/S0108270195003714","","","0.71073","MoKα","","","0.063","","","0.057","","","","","1.178","1.178","","","","","has coordinates","297161","2025-01-07","07:07:21",""
"2003980","15.63","0.002","7.722","0.002","12.986","0.002","90","","113.44","0.02","90","","1438","0.5","293","","","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C13 H20 O5 S -","- C13 H20 O5 S -","- C52 H80 O20 S4 -","4","1","AS1180","Lin, Chu-Chung; Lin, Chu-Cheng","S-Methyl (2R,6S,8S)-2,6-Dimethoxy-4-methyl-3,5-dioxatricyclo[5.2.1.0^4,9^]decane-8-thioate","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","10","2143","2145","10.1107/S0108270195005622","","","0.71069","MoKα","","","0.0556","","","0.0918","","","","","1.69","1.69","","","","","has coordinates","301791","2025-08-18","23:15:25",""
"2004001","8.586","0.008","15.286","0.011","15.606","0.008","94.57","0.04","92.31","0.04","100.58","0.04","2004","3","295","2","","","","","","","","","?","5","P -1","-P 1","2","","","","- C22 H16 N2 S Se2 -","- C22 H16 N2 S Se2 -","- C88 H64 N8 S4 Se8 -","4","2","","Billing, David G.; Levendis, Demetrius C.; Reid, David H.; Rose, Beate G.","3,5-Diphenyl-2-(2-pyridylamino)-1-thia-6,6aλ^4^-diselenapentalene","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","10","2057","2059","10.1107/s0108270195001119","","","0.71067","MoKα","","","0.055","","","0.1576","","","","","0.895","0.895","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2004051","9.5394","0.0004","8.5756","0.0002","5.2508","0.0003","90","","110.124","0.002","90","","403.32","0.03","273","","","","","","","","","","Ohashi, Osawa & Sato (1989)","4","P 1 21/c 1","-P 2ybc","14","","","","- Ga Li O6 Si2 -","- Ga Li O6 Si2 -","- Ga4 Li4 O24 Si8 -","4","1","","Sato, Akira; Osawa, Toshikazu; Ohashi, Haruo","Low-Temperature Form of LiGaSi~2~O~6~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","10","1959","1960","10.1107/s0108270195004732","","","0.71073","MoKα","","","0.041","","","0.043","","","","","1.4","1.4","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2004075","9.131","0.002","6.775","0.001","7.769","0.002","90","","116.22","0.02","90","","431.1","0.2","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F11 Mn Na Zr2 -","- F11 Mn Na Zr2 -","- F22 Mn2 Na2 Zr4 -","2","0.25","","Kettani, M. H.; Avignant, D.; Metin, J.","NaM^II^Zr~2~F~11~ (M^II^ = Mn, Fe, Co, Ni, Zn) Fluorides","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","11","2207","2210","10.1107/s0108270195006081","","","","","","","","","","","","","","","","","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2004076","9.069","0.003","6.736","0.001","7.757","0.001","90","","116.22","0.01","90","","425.1","0.2","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F11 Fe Na Zr2 -","- F11 Fe Na Zr2 -","- F22 Fe2 Na2 Zr4 -","2","0.25","","Kettani, M. H.; Avignant, D.; Metin, J.","NaM^II^Zr~2~F~11~ (M^II^ = Mn, Fe, Co, Ni, Zn) Fluorides","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","11","2207","2210","10.1107/s0108270195006081","","","","","","","","","","","","","","","","","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2004077","9.037","0.001","6.7","0.001","7.725","0.002","90","","116.26","0.01","90","","419.5","0.1","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- Co F11 Na Zr2 -","- Co F11 Na Zr2 -","- Co2 F22 Na2 Zr4 -","2","0.25","","Kettani, M. H.; Avignant, D.; Metin, J.","NaM^II^Zr~2~F~11~ (M^II^ = Mn, Fe, Co, Ni, Zn) Fluorides","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","11","2207","2210","10.1107/s0108270195006081","","","","","","","","","","","","","","","","","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2004078","9.002","0.002","6.675","0.001","7.709","0.001","90","","116.24","0.02","90","","415.5","0.2","293","","","","","","","","","","","4","C 1 2/m 1","-C 2y","12","","","","- F11 Na Ni Zr2 -","- F11 Na Ni Zr2 -","- F22 Na2 Ni2 Zr4 -","2","0.25","","Kettani, M. H.; Avignant, D.; Metin, J.","NaM^II^Zr~2~F~11~ (M^II^ = Mn, Fe, Co, Ni, Zn) Fluorides","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","11","2207","2210","10.1107/s0108270195006081","","","","","","","","","","","","","","","","","","","","","has coordinates","200796","2020-10-21","18:00:00",""
"2004240","9.197","0.004","3.1228","0.0009","12.303","0.004","90","","104.26","0.03","90","","342.5","0.4","293","","","","","","","","","","Synthetic","3","P 1 21/c 1","-P 2ybc","14","","","Suanite","- B2 Mg2 O5 -","- B2 Mg2 O5 -","- B8 Mg8 O20 -","4","1","","Guo, Guo-Cong; Cheng, Wen-Dan; Chen, Jiu-Tong; Zhuang, Hong-Hui; Huang, Jin-Shun; Zhang, Qian-Er","Monoclinic Mg~2~B~2~O~5~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","12","2469","2471","10.1107/s0108270195008298","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2004306","9.5573","0.0005","8.7019","0.0002","5.2705","0.0003","90","","107.637","0.002","90","","417.73","0.04","296","","","","","","","","","","","4","C 1 2/c 1","-C 2yc","15","","","","- Ga Na O6 Si2 -","- Ga Na O6 Si2 -","- Ga4 Na4 O24 Si8 -","4","0.5","","Ohashi, Haruo; Osawa, Toshikazu; Sato, Akira","Low-Density Form of NaGaSi~2~O~6~","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","12","2476","2477","10.1107/s010827019500775x","","","","","","","","","","","","","","","","","","","","","has coordinates","282068","2023-03-26","10:12:03",""
"2010384","6.4","0.001","10.767","0.001","11.203","0.002","91.62","0.01","91.34","0.02","102.2","0.2","753.9","0.2","295","2","","","","","","","","","","4","P -1","-P 1","2","","","","- C15 H23 N2 O3 -","- C15 H23 N2 O3 -","- C30 H46 N4 O6 -","2","1","","Olszak, Tomasz A.; Sobczynski, Piotr H.; Brzozowski, A. M.; Grabowski, M. J.; Gwozdzinski, Krzysztof","Piperidine Nitroxide Radicals with Heterocyclic Ring Substituents. 4-Hydroxy-2,2,6,6-tetramethyl-4-(2-pyridylmethyl 1-oxide)piperidine 1-oxide","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","1","121","123","10.1107/s0108270194007791","","","","","","","0.045","","","0.043","","","","","","","","","","","has coordinates","278247","2022-09-28","15:09:32",""
"2010477","5.603","0.002","23.641","0.004","12.643","0.002","73.42","0.01","76.34","0.03","84.92","0.02","1559","1","286","","296","","","","","","","","","5","P -1","-P 1","2","","4-(Diphenylmethylimino-oxy)tetrafluoropyridine","","- C18 H10 F4 N2 O -","- C18 H10 F4 N2 O -","- C72 H40 F16 N8 O4 -","4","2","LI1121","Banks, R. E.; Jondi, W. J.; Pritchard, R. G.; Tipping, A. E.","Benzophenone O-4-(2,3,5,6-Tetrafluoro)pyridyloxime, Formed by 4-Substitution of Pentafluoropyridine by Benzophenone Oximate","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","291","293","10.1107/s0108270194009121","","","0.71069","MoKα","","","0.037","","","0.025","","","","","2.32","2.32","","","","","has coordinates","301798","2025-08-19","06:41:46",""
"2010500","18.688","0.009","11.428","0.006","15.797","0.008","90","","90","","90","","3374","3","293","","293","","","","","","","","","5","P b c a","-P 2ac 2ab","61","","cis-5-Methyl-4-phenyl-3-(4-toluenesulfonyl)-1,3-oxazin-2-one","","- C18 H19 N O4 S -","- C18 H19 N O4 S -","- C144 H152 N8 O32 S8 -","8","1","TA1011","Campi, Eva M.; Fallon, Gary D.; Holmes, Andrea; Perlmutter, Patrick; Teo, Chin C.","cis-5-Methyl-4-phenyl-3-(4-toluenesulfonyl)-1,3-oxazin-2-one","Acta Crystallographica, Section C: Crystal Structure Communications","1995","51","2","279","280","10.1107/S0108270194008838","","","1.5418","CuKα","","0.068","0.048","","0.106","0.058","","","","","0.772","0.772","","","","","has coordinates","301798","2025-08-19","06:41:46",""