Search results

Formula: - C8 H8 Cu N10 O4 -
Comments: Kožíšek, Jozef; Hansen, Niels, K.; Fuess, Hartmut Nucleophilic addition reaction in coordinated non-linear pseudohalides : Experimental Charge Density Analysis in trans-bis(cyanamidonitrato-N:O) bis(imidazole-N^3^) copper(II) complex. Acta Crystallographica, Section B 58(3) (2002) 463-470
Space group: P 1 21/c 1
Cell volume: 652.49
Cell parameters: 7.1248; 13.6; 6.7973; 90; 97.821; 90;

COD ID: 2103096
CIF file Original IUCr paper	Formula: - Cl2 H8 Mg O4 - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: P 1 21/c 1 Cell volume: 337.2 Cell parameters: 5.9001; 7.2709; 8.4199; 90; 111.007; 90;

COD ID: 2103097
CIF file Original IUCr paper	Formula: - C2 H14 Fe2 N2 O11 - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: C m c m Cell volume: 480.944 Cell parameters: 6.6154; 12.0639; 6.0263; 90; 90; 90;

COD ID: 2103098
CIF file Original IUCr paper	Formula: - Cl2 H4 Mg O2 - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: C 1 2/m 1 Cell volume: 227.69 Cell parameters: 7.389; 8.55; 3.6488; 90; 98.96; 90;

COD ID: 2103099
CIF file Original IUCr paper	Formula: - Cl2 H2 Mg O - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: P n m a Cell volume: 368.6 Cell parameters: 8.899; 3.634; 11.398; 90; 90; 90;

COD ID: 2103100
CIF file Original IUCr paper	Formula: - Al4 H50 O52 S7 - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: P -1 Cell volume: 1026.68 Cell parameters: 12.5882; 13.0724; 7.3353; 108.162; 70.536; 112.658;

COD ID: 2103101
CIF file Original IUCr paper	Formula: - Fe H2 O5 S - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: C 1 2/c 1 Cell volume: 364.4 Cell parameters: 7.1157; 7.518; 7.5988; 90; 116.307; 90;

COD ID: 2103102
CIF file Original IUCr paper	Formula: - Al2 H34 O29 S3 - Comments: Kaduk, James A. Use of the Inorganic Crystal Structure Database as a problem solving tool Acta Crystallographica, Section B: Structural Science 58(3) (2002) 370-379 Space group: P -1 Cell volume: 1202.7 Cell parameters: 7.42; 26.97; 6.062; 89.57; 97.34; 91.53;

COD ID: 2103104
CIF file Original IUCr paper	Formula: - C24 H20 Hg K N4 S20 - Comments: Kazheva, Olga; Canadell, Enric; Aleksandrov, Grigorii; Kushch, Nataliya; Dyachenko, Oleg Crystal and electronic structure of a new metallic modification of (ET)~2~[KHg(NCS)~4~] Acta Crystallographica, Section B 58(2) (2002) 471-476 Space group: P -1 Cell volume: 1984.3 Cell parameters: 6.648; 14.888; 20.38; 86.2; 86.02; 81;

COD ID: 2103105
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: C 1 2/c 1 Cell volume: 1961.1 Cell parameters: 15.824; 9.1501; 13.894; 90; 102.879; 90;

COD ID: 2103106
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: P -1 Cell volume: 482.8 Cell parameters: 7.529; 8.9503; 9.0513; 118.425; 109.414; 95.139;

COD ID: 2103107
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: P -1 Cell volume: 1938.8 Cell parameters: 14.064; 8.9554; 18.117; 118.407; 90.832; 76.46;

COD ID: 2103108
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: P -1 Cell volume: 475.8 Cell parameters: 7.513; 8.615; 9.029; 114.24; 113.3; 91.92;

COD ID: 2103109
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: P -1 Cell volume: 484.66 Cell parameters: 7.5567; 8.8956; 8.9921; 116.697; 112.099; 92.101;

COD ID: 2103110
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: C 1 2/m 1 Cell volume: 1012.9 Cell parameters: 9.754; 15.41; 7.555; 90; 116.88; 90;

COD ID: 2103111
CIF file Original IUCr paper	Formula: - C20 H18 Cl4 N2 - Comments: Britton, Doyle Planar packing of tetrachlorodicyanobenzene isomers Acta Crystallographica, Section B: Structural Science 58(3) (2002) 553-563 Space group: P -1 Cell volume: 980.1 Cell parameters: 7.4982; 9.0371; 15.4538; 85.08; 81.795; 71.168;

COD ID: 2103112

Formula: - C14 H14 Cl5 N4 P3 -
Comments: Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene Acta Crystallographica, Section B: Structural Science 58(3) (2002) 545-552
Space group: P 1 21/n 1
Cell volume: 2112.9
Cell parameters: 11.125; 8.1671; 23.585; 90; 99.61; 90;

COD ID: 2103113

Formula: - C28 H28 Cl4 N5 P3 -
Comments: Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene Acta Crystallographica, Section B: Structural Science 58(3) (2002) 545-552
Space group: P b c a
Cell volume: 6067
Cell parameters: 18.294; 17.411; 19.047; 90; 90; 90;

COD ID: 2103114

Formula: - C26 H24 Cl3 N4 P3 -
Comments: Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene Acta Crystallographica, Section B: Structural Science 58(3) (2002) 545-552
Space group: P 1 n 1
Cell volume: 1370.5
Cell parameters: 11.657; 8.5838; 13.783; 90; 96.41; 90;

COD ID: 2103115

Formula: - C40 H38 Cl2 N5 P3 -
Comments: Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene Acta Crystallographica, Section B: Structural Science 58(3) (2002) 545-552
Space group: P 1 21/n 1
Cell volume: 3709.18
Cell parameters: 10.281; 21.0219; 17.3783; 90; 99.047; 90;

COD ID: 2103116

Formula: - C5 H12 Cl4 N5 P3 -
Comments: Beşli, Serap; Coles, Simon J.; Davies, David B.; Hursthouse, Michael B.; Kılıç, Adem; Mayer, Thomas A.; Shaw, Robert A.; Uslu, Aylin Structural investigations of phosphorus‒nitrogen compounds. 4. Steric and electronic effects in dibenzylamino derivatives of hexachlorocyclotriphosphazatriene and 4,4,6,6-tetrachloro-2,2-diphenylcyclotriphosphazatriene Acta Crystallographica, Section B: Structural Science 58(3) (2002) 545-552
Space group: P 21 21 21
Cell volume: 1479.13
Cell parameters: 7.8379; 13.4076; 14.0752; 90; 90; 90;

COD ID: 2103117
CIF file Original IUCr paper	Formula: - C9 H12 O4 - Comments: Duncan, Laura L.; Patrick, Brian O.; Brock, Carolyn Pratt Two phases of C~9~H~12~O~4~: why is the structure at 295K so complicated? Acta Crystallographica, Section B: Structural Science 58(3) (2002) 502-511 Space group: C m c 21 Cell volume: 4622 Cell parameters: 10.474; 66.24; 6.662; 90; 90; 90;

COD ID: 2103118
CIF file Original IUCr paper	Formula: - C9 H12 O4 - Comments: Duncan, Laura L.; Patrick, Brian O.; Brock, Carolyn Pratt Two phases of C~9~H~12~O~4~: why is the structure at 295K so complicated? Acta Crystallographica, Section B: Structural Science 58(3) (2002) 502-511 Space group: P m n b Cell volume: 1767.8 Cell parameters: 10.471; 26.24; 6.434; 90; 90; 90;

COD ID: 2103119
CIF file Original IUCr paper	Formula: - C Ca O3 - Comments: Bevan, D. J. M.; Rossmanith, Elisabeth; Mylrea, Darren K.; Ness, Sharon E.; Taylor, Max R.; Cuff, Chris On the structure of aragonite – Lawrence Bragg revisited Acta Crystallographica, Section B: Structural Science 58(3) (2002) 448-456 Space group: P -1 Cell volume: 226.96 Cell parameters: 5.7394; 4.9616; 7.97; 89.999; 90.012; 89.996;

COD ID: 2103120

Formula: - C6 H10 O3 -
Comments: Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Novel predicted patterns of supramolecular self-assembly afforded by tetrameric R~4~^4^(12) rings of C~2~ symmetry in the crystal structures of 2-hydroxy-1-cyclopentanecarboxylic acid, 2-hydroxy-1- cyclohexanecarboxylic acid and 2-hydroxy-1-cycloheptanecarboxylic acid. Acta Crystallographica, Section B 58(3) (2002) 494-501
Space group: C 1 2/c 1
Cell volume: 1304.5
Cell parameters: 17.383; 6.188; 12.361; 90; 101.16; 90;

COD ID: 2103121

Formula: - C7 H12 O3 -
Comments: Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Novel predicted patterns of supramolecular self-assembly afforded by tetrameric R~4~^4^(12) rings of C~2~ symmetry in the crystal structures of 2-hydroxy-1-cyclopentanecarboxylic acid, 2-hydroxy-1- cyclohexanecarboxylic acid and 2-hydroxy-1-cycloheptanecarboxylic acid. Acta Crystallographica, Section B 58(3) (2002) 494-501
Space group: C 1 2/c 1
Cell volume: 1534.9
Cell parameters: 21.436; 5.974; 12.095; 90; 97.7; 90;

COD ID: 2103122

Formula: - C8 H14 O3 -
Comments: Kálmán, Alajos; Fábián, László; Argay, Gyula; Bernáth, Gábor; Gyarmati, Zsuzsanna Novel predicted patterns of supramolecular self-assembly afforded by tetrameric R~4~^4^(12) rings of C~2~ symmetry in the crystal structures of 2-hydroxy-1-cyclopentanecarboxylic acid, 2-hydroxy-1- cyclohexanecarboxylic acid and 2-hydroxy-1-cycloheptanecarboxylic acid. Acta Crystallographica, Section B 58(3) (2002) 494-501
Space group: I 1 2/c 1
Cell volume: 1671.2
Cell parameters: 22.876; 6.224; 11.793; 90; 95.56; 90;

COD ID: 2103123
CIF file Original IUCr paper	Formula: - C24 H54 O3 Si3 - Comments: Herbst-Irmer, Regine; Sheldrick, George M. Refinement of obverse/reverse twins Acta Crystallographica, Section B: Structural Science 58(3) (2002) 477-481 Space group: R -3 c :H Cell volume: 4259.1 Cell parameters: 10.0793; 10.0793; 48.409; 90; 90; 120;

COD ID: 2103124
CIF file Original IUCr paper	Formula: - C50 H121 Al3 F10 Li4 O5 Si9 - Comments: Herbst-Irmer, Regine; Sheldrick, George M. Refinement of obverse/reverse twins Acta Crystallographica, Section B: Structural Science 58(3) (2002) 477-481 Space group: R 3 :H Cell volume: 5857.9 Cell parameters: 14.899; 14.899; 30.472; 90; 90; 120;

COD ID: 2103125
CIF file Original IUCr paper	Formula: - C5 H11 N4 O4 P - Comments: Slouf, Miroslav; Holy, Antonin; Petricek, Vaclav; Cisarova, Ivana Charge density study of hydrogen-[(2,4-diaminopyrimidin-1-io)methyl]phosphonate monohydrate Acta Crystallographica, Section B 58(1) (2002) 519-529 Space group: P 1 21/n 1 Cell volume: 900.88 Cell parameters: 5.8389; 19.3579; 8.0338; 90; 97.203; 90;

COD ID: 2103126
CIF file Original IUCr paper	Formula: - C14 H26 N2 O10 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: P 1 Cell volume: 445.24 Cell parameters: 5.8757; 7.8751; 10.6165; 70.345; 74.5; 87.435;

COD ID: 2103127
CIF file Original IUCr paper	Formula: - C14 H14 N2 O5 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: P 1 Cell volume: 323.21 Cell parameters: 5.1647; 6.2749; 10.2126; 83.235; 89.808; 79.601;

COD ID: 2103128
CIF file Original IUCr paper	Formula: - C28 H28 N4 O10 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: C 1 2 1 Cell volume: 1338.9 Cell parameters: 20.5; 4.6656; 14.201; 90; 99.68; 90;

COD ID: 2103129
CIF file Original IUCr paper	Formula: - C14 H14 N2 O5 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: P 1 21/c 1 Cell volume: 1329.74 Cell parameters: 14.1274; 4.7459; 20.1749; 90; 100.565; 90;

COD ID: 2103130
CIF file Original IUCr paper	Formula: - C16 H16 N2 O5 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: P 1 Cell volume: 361.41 Cell parameters: 4.9325; 8.3343; 9.3502; 72.751; 89.414; 80.207;

COD ID: 2103131
CIF file Original IUCr paper	Formula: - C16 H16 N2 O5 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: P -1 Cell volume: 363.24 Cell parameters: 4.9566; 8.4178; 9.2538; 73.213; 89.915; 79.75;

COD ID: 2103132
CIF file Original IUCr paper	Formula: - C14 H24 N2 O10 - Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: malate salts of organic diamines Acta Crystallographica, Section B 58(3) (2002) 530-544 Space group: P 1 21/c 1 Cell volume: 3324.61 Cell parameters: 12.7309; 20.9103; 12.54; 90; 95.178; 90;

COD ID: 2103133
CIF file Original IUCr paper	Formula: - B6 Ce - Comments: Tanaka, Kiyoaki; Ōnuki, Yoshichika Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction Acta Crystallographica, Section B: Structural Science 58(3) (2002) 423-436 Space group: P m -3 m Cell volume: 70.788 Cell parameters: 4.1367; 4.1367; 4.1367; 90; 90; 90;

COD ID: 2103134
CIF file Original IUCr paper	Formula: - B6 Ce - Comments: Tanaka, Kiyoaki; Ōnuki, Yoshichika Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction Acta Crystallographica, Section B: Structural Science 58(3) (2002) 423-436 Space group: P m -3 m Cell volume: 70.862 Cell parameters: 4.1381; 4.1381; 4.1381; 90; 90; 90;

COD ID: 2103135
CIF file Original IUCr paper	Formula: - B6 Ce - Comments: Tanaka, Kiyoaki; Ōnuki, Yoshichika Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction Acta Crystallographica, Section B: Structural Science 58(3) (2002) 423-436 Space group: P m -3 m Cell volume: 70.914 Cell parameters: 4.1391; 4.1391; 4.1391; 90; 90; 90;

COD ID: 2103136
CIF file Original IUCr paper	Formula: - B6 Ce - Comments: Tanaka, Kiyoaki; Ōnuki, Yoshichika Observation of 4<i>f</i> electron transfer from Ce to B~6~ in the Kondo crystal CeB~6~ and its mechanism by multi-temperature X-ray diffraction Acta Crystallographica, Section B: Structural Science 58(3) (2002) 423-436 Space group: P m -3 m Cell volume: 70.996 Cell parameters: 4.1407; 4.1407; 4.1407; 90; 90; 90;

COD ID: 2103137
CIF file Original IUCr paper	Formula: - C14 H24 N2 O5 - Comments: Görbitz, Carl Henrik b Turns, water cage formation and hydrogen bonding in the structures of L-Valyl-L-phenylalanine Acta Crystallographica, Section B 58(3) (2002) 512-518 Space group: P 21 21 21 Cell volume: 1556.9 Cell parameters: 5.6595; 8.3306; 33.022; 90; 90; 90;

COD ID: 2103138
CIF file Original IUCr paper	Formula: - C14 H26 N2 O6 - Comments: Görbitz, Carl Henrik b Turns, water cage formation and hydrogen bonding in the structures of L-Valyl-L-phenylalanine Acta Crystallographica, Section B 58(3) (2002) 512-518 Space group: P 1 21 1 Cell volume: 7015.5 Cell parameters: 10.3137; 45.2095; 15.5891; 90; 105.171; 90;

COD ID: 2103139

Formula: - C74 H16 Cr -
Comments: Hönnerscheid, Andreas; Dinnebier, Robert; Jansen, Martin Reversible dimerization of C~60~ molecules in the crystal structure of the bis(arene)chromium fulleride [Cr(C~7~H~8~)]~2~C~60~ Acta Crystallographica, Section B: Structural Science 58(3) (2002) 482-488
Space group: P -1
Cell volume: 1924.78
Cell parameters: 13.6414; 13.8338; 13.8548; 91.83; 116.776; 119.333;

COD ID: 2103140
CIF file Original IUCr paper	Formula: - C48 H92 O6 - Comments: Helmholdt, Robert B.; Peschar, René; Schenk, Henk Structure of C~15~-, C~17~- and C~19~-mono-acid β-triacylglycerols Acta Crystallographica Section B 58(1) (2002) 134-139 Space group: P -1 Cell volume: 2448.94 Cell parameters: 11.89979; 46.3879; 5.43998; 72.359; 100.211; 121.125;

COD ID: 2103141
CIF file Original IUCr paper	Formula: - C54 H104 O6 - Comments: Helmholdt, Robert B.; Peschar, René; Schenk, Henk Structure of C~15~-, C~17~- and C~19~-mono-acid β-triacylglycerols Acta Crystallographica Section B 58(1) (2002) 134-139 Space group: P -1 Cell volume: 2725.82 Cell parameters: 11.86642; 51.4495; 5.43208; 72.765; 100.095; 120.577;

COD ID: 2103142
CIF file Original IUCr paper	Formula: - C60 H116 O6 - Comments: Helmholdt, Robert B.; Peschar, René; Schenk, Henk Structure of C~15~-, C~17~- and C~19~-mono-acid β-triacylglycerols Acta Crystallographica Section B 58(1) (2002) 134-139 Space group: P -1 Cell volume: 3011.82 Cell parameters: 11.86797; 56.5143; 5.42795; 73.064; 100.02; 120.084;

COD ID: 2103143

Formula: - C10.77 H8 N0.77 S8.77 -
Comments: Kazheva, Olga N.; Canadell, Enric; Aleksandrov, Grigorii G.; Kushch, Nataliya D.; Dyachenko, Oleg A. Quasi-three-dimensional network of molecular interactions and electronic structure of a new organic semiconductor, ET(NCS)~0.77~ Acta Crystallographica Section B 58(1) (2002) 148-152
Space group: P b c m
Cell volume: 1587.1
Cell parameters: 6.638; 8.309; 28.776; 90; 90; 90;

COD ID: 2103144

Formula: - C6 H3 Cl N2 O2 -
Comments: Pink, Maren; Britton, Doyle 5-Chloro- and 5-bromobenzfurazan 1-oxide revisited Acta Crystallographica Section B 58(1) (2002) 116-124
Space group: P 1 21/n 1
Cell volume: 696.4
Cell parameters: 7.973; 7.0579; 12.389; 90; 92.683; 90;

COD ID: 2103145

Formula: - C6 H3 Cl N2 O2 -
Comments: Pink, Maren; Britton, Doyle 5-Chloro- and 5-bromobenzfurazan 1-oxide revisited Acta Crystallographica Section B 58(1) (2002) 116-124
Space group: P 1 21/n 1
Cell volume: 675.7
Cell parameters: 7.8317; 7.0527; 12.2576; 90; 93.612; 90;

COD ID: 2103146

Formula: - C6 H3 Br N2 O2 -
Comments: Pink, Maren; Britton, Doyle 5-Chloro- and 5-bromobenzfurazan 1-oxide revisited Acta Crystallographica Section B 58(1) (2002) 116-124
Space group: P 1 21/n 1
Cell volume: 729.8
Cell parameters: 7.954; 7.297; 12.574; 90; 90.124; 90;

COD ID: 2103147

Formula: - C6 H3 Br N2 O2 -
Comments: Pink, Maren; Britton, Doyle 5-Chloro- and 5-bromobenzfurazan 1-oxide revisited Acta Crystallographica Section B 58(1) (2002) 116-124
Space group: P 1 21/c 1
Cell volume: 1413.06
Cell parameters: 14.5294; 7.4121; 14.5587; 90; 115.676; 90;

COD ID: 2103148
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/m 1 Cell volume: 645.3 Cell parameters: 9.753; 6.933; 9.572; 90; 94.39; 90;

COD ID: 2103149
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/m 1 Cell volume: 646.16 Cell parameters: 9.753; 6.941; 9.573; 90; 94.38; 90;

COD ID: 2103150
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/m 1 Cell volume: 647.07 Cell parameters: 9.756; 6.947; 9.575; 90; 94.36; 90;

COD ID: 2103151

Formula: - C14 H18 O3 -
Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133
Space group: P 1 21/n 1
Cell volume: 1248.7
Cell parameters: 13.449; 6.757; 13.746; 90; 91.54; 90;

COD ID: 2103152

Formula: - C14 H18 O3 -
Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133
Space group: P 1 21/n 1
Cell volume: 1256
Cell parameters: 13.429; 6.784; 13.792; 90; 91.54; 90;

COD ID: 2103153
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/n 1 Cell volume: 1277.6 Cell parameters: 13.345; 6.853; 13.973; 90; 91.25; 90;

COD ID: 2103154

Formula: - C14 H18 O3 -
Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133
Space group: P 1 21/n 1
Cell volume: 1276.9
Cell parameters: 13.344; 6.854; 13.964; 90; 91.18; 90;

COD ID: 2103155
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/n 1 Cell volume: 1277.6 Cell parameters: 13.341; 6.857; 13.969; 90; 91.18; 90;

COD ID: 2103156
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/c 1 Cell volume: 1275.8 Cell parameters: 9.76; 6.863; 19.113; 90; 94.75; 90;

COD ID: 2103157
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/c 1 Cell volume: 1279.6 Cell parameters: 9.758; 6.883; 19.117; 90; 94.75; 90;

COD ID: 2103158
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/c 1 Cell volume: 1268.5 Cell parameters: 9.729; 6.868; 19.047; 90; 94.67; 90;

COD ID: 2103159
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/c 1 Cell volume: 1276.2 Cell parameters: 9.739; 6.895; 19.066; 90; 94.57; 90;

COD ID: 2103160
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/c 1 Cell volume: 1291.7 Cell parameters: 9.768; 6.933; 19.13; 90; 94.39; 90;

COD ID: 2103161
CIF file Original IUCr paper	Formula: - C14 H18 O3 - Comments: Budzianowski, Armand; Katrusiak, Andrzej Coupling of the lactone-ring conformation with crystal symmetry in 6-hydroxy-4,4,5,7,8-pentamethyl-3,4-dihydrocoumarin Acta Crystallographica Section B 58(1) (2002) 125-133 Space group: P 1 21/c 1 Cell volume: 1285 Cell parameters: 9.744; 6.922; 19.109; 90; 94.44; 90;

COD ID: 2103162
CIF file Original IUCr paper	Formula: - C97 H205 O91.5 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2 1 Cell volume: 7178.96 Cell parameters: 19.363; 24.597; 15.937; 90; 108.95; 90;

COD ID: 2103163
CIF file Original IUCr paper	Formula: - C98 H195.8 O86.9 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2 1 Cell volume: 7153.17 Cell parameters: 19.316; 24.564; 15.935; 90; 108.9; 90;

COD ID: 2103164
CIF file Original IUCr paper	Formula: - C20 H10 S10 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/c 1 Cell volume: 2332.69 Cell parameters: 6.044; 22.726; 17.025; 90; 94.033; 90;

COD ID: 2103165
CIF file Original IUCr paper	Formula: - C45 H28 N5 Tl - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/n 1 Cell volume: 3454.28 Cell parameters: 10.003; 16.231; 21.277; 89.98; 90.57; 90.31;

COD ID: 2103166
CIF file Original IUCr paper	Formula: - C25 H36 Br Cr N O2 P2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/n 1 Cell volume: 2858.96 Cell parameters: 10.084; 16.34; 17.351; 89.89; 89.87; 89.98;

COD ID: 2103167
CIF file Original IUCr paper	Formula: - C38 H46 Cl2 N8 Ni2 O10 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 4446.09 Cell parameters: 22.946; 14.728; 14.679; 90.02; 116.33; 89.94;

COD ID: 2103168
CIF file Original IUCr paper	Formula: - C22 H10 Cl12 Cu2 N2 O8 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3621.38 Cell parameters: 23.468; 10.13; 18.911; 90; 126.34; 90;

COD ID: 2103169
CIF file Original IUCr paper	Formula: - C28 H28 Cd2 N8 S4 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3337.46 Cell parameters: 20.103; 9.299; 20.023; 90.01; 116.92; 90.02;

COD ID: 2103170
CIF file Original IUCr paper	Formula: - C30 H52 S8 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3712.49 Cell parameters: 36.62; 5.498; 18.47; 89.98; 93.31; 90.01;

COD ID: 2103171
CIF file Original IUCr paper	Formula: - C16 H7 N O10 Os3 S - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 4286.89 Cell parameters: 25.815; 8.67; 19.42; 90.02; 99.5; 90.08;

COD ID: 2103172
CIF file Original IUCr paper	Formula: - C13 H23 Nd O2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 1430.48 Cell parameters: 14.223; 7.813; 13.813; 90.26; 111.26; 90;

COD ID: 2103173
CIF file Original IUCr paper	Formula: - C36 H36 Cl2 Mn N2 O6 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3409.26 Cell parameters: 23; 8.568; 18.991; 90.02; 114.36; 89.99;

COD ID: 2103174
CIF file Original IUCr paper	Formula: - C42 H35 Cl2 P2 Rh - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3630 Cell parameters: 12.99; 13.93; 20.11; 90.3; 94; 90.1;

COD ID: 2103175
CIF file Original IUCr paper	Formula: - C8 H16 N4 Ni4 O2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 4931.16 Cell parameters: 22.177; 13.638; 18.663; 89.98; 119.12; 90;

COD ID: 2103176
CIF file Original IUCr paper	Formula: - C27 H28 Ir N3 O4 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 21 21 21 Cell volume: 2398 Cell parameters: 10.322; 17.864; 13.005; 90; 90.24; 90;

COD ID: 2103177
CIF file Original IUCr paper	Formula: - C62 H110 O36 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 2 2 21 Cell volume: 7623.82 Cell parameters: 15.571; 21.116; 23.187; 90; 90; 89.95;

COD ID: 2103178
CIF file Original IUCr paper	Formula: - C11 H6 Cl5 N O - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 2 2 21 Cell volume: 2679.39 Cell parameters: 7.246; 15.512; 23.838; 90; 90; 90.06;

COD ID: 2103179
CIF file Original IUCr paper	Formula: - C31 H44 B2 Cu2 N12 O3 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C m c 21 Cell volume: 3697.44 Cell parameters: 13.498; 8.834; 31.008; 90; 90; 89.97;

COD ID: 2103180
CIF file Original IUCr paper	Formula: - C20 H38 B2 U - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: F m m 2 Cell volume: 2191 Cell parameters: 17.639; 15.172; 8.187; 90; 90; 90;

COD ID: 2103181
CIF file Original IUCr paper	Formula: - C6 H12 N3 O P - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: R 3 m :R Cell volume: 181.512 Cell parameters: 5.8847; 5.8847; 5.8847; 104.09; 104.09; 104.09;

COD ID: 2103182
CIF file Original IUCr paper	Formula: - C6 H12 N3 P S - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: R 3 m :R Cell volume: 207.455 Cell parameters: 6.0482; 6.0482; 6.0482; 100.9; 100.9; 100.9;

COD ID: 2103183
CIF file Original IUCr paper	Formula: - H12 Li Mo3 Na3 O18 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: R 3 c :H Cell volume: 2058.69 Cell parameters: 8.735; 8.732; 31.163; 90; 90.01; 119.99;

COD ID: 2103184
CIF file Original IUCr paper	Formula: - C10 H21 Cl2 K2 N2 O8.5 Pd - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P c c n Cell volume: 1999.05 Cell parameters: 15.533; 16.225; 7.932; 90; 89.97; 90;

COD ID: 2103185
CIF file Original IUCr paper	Formula: - C16 H26 O2 Rh2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: I 41/a :2 Cell volume: 6134.43 Cell parameters: 22.409; 22.409; 12.216; 90; 90; 89.99;

COD ID: 2103186
CIF file Original IUCr paper	Formula: - C48 H80 Cl4 N8 O32 Zn2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: I 41/a c d :2 Cell volume: 5905.95 Cell parameters: 19.265; 19.265; 15.913; 90; 90; 90;

COD ID: 2103187
CIF file Original IUCr paper	Formula: - C5 H5 N O - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 41 21 2 Cell volume: 465.004 Cell parameters: 5.816; 5.816; 13.747; 90; 90; 90;

COD ID: 2103188
CIF file Original IUCr paper	Formula: - C15 H10 N2 O2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 41 21 2 Cell volume: 1235.48 Cell parameters: 9.591; 9.591; 13.431; 90; 90; 90;

COD ID: 2103189
CIF file Original IUCr paper	Formula: - C14 H30 F6 N6 O6 S2 Zn - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 21 3 Cell volume: 2518.45 Cell parameters: 13.6054; 13.6054; 13.6054; 90; 90; 90;

COD ID: 2103190
CIF file Original IUCr paper	Formula: - C6 H12 N3 P - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: R 3 m :R Cell volume: 187.069 Cell parameters: 6.024; 6.024; 6.024; 105.94; 105.94; 105.94;

COD ID: 2103191
CIF file Original IUCr paper	Formula: ? Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 63/m Cell volume: 7057.78 Cell parameters: 22.59; 22.59; 15.97; 90; 90; 120;

COD ID: 2103192
CIF file Original IUCr paper	Formula: - C4 H12 Cl4 N6 S3 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: R -3 :H Cell volume: 2616.92 Cell parameters: 15.53; 15.53; 12.529; 90; 90; 120;

COD ID: 2103193
CIF file Original IUCr paper	Formula: - C10 H16 O2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 63/m c m Cell volume: 1338.16 Cell parameters: 11.885; 11.885; 10.939; 90; 90; 120;

COD ID: 2103194
CIF file Original IUCr paper	Formula: - C4 H22 Cl7 N4 O Ru - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/m 1 Cell volume: 843.24 Cell parameters: 10.393; 10.031; 8.089; 90; 90.66; 90;

COD ID: 2103195
CIF file Original IUCr paper	Formula: - C6 H5 N Na O6.5 S - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 2/c 1 Cell volume: 1851.39 Cell parameters: 8.293; 16.58; 13.465; 90; 90.29; 90;

COD ID: 2103196
CIF file Original IUCr paper	Formula: - C6 Cd3 I2 N6 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/m 1 Cell volume: 1695.17 Cell parameters: 15.467; 8.541; 12.84; 90; 92.01; 90;

COD ID: 2103197
CIF file Original IUCr paper	Formula: - C12 H28 Cu N6 O6 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/m 1 Cell volume: 866.216 Cell parameters: 10.059; 9.278; 10.428; 90; 117.12; 90;

COD ID: 2103198
CIF file Original IUCr paper	Formula: - C17 H2 Co Ir O2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/m 1 Cell volume: 1653.53 Cell parameters: 17.305; 9.299; 10.297; 90; 93.7; 90;

COD ID: 2103199
CIF file Original IUCr paper	Formula: - C2 H12 F6 N6 Ti - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/m 1 Cell volume: 539.6 Cell parameters: 12.869; 7.378; 6.243; 90; 114.45; 90;

COD ID: 2103200
CIF file Original IUCr paper	Formula: - C106 H38 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/m 1 Cell volume: 2962.34 Cell parameters: 13.26; 15.177; 15.764; 90; 110.97; 90;

COD ID: 2103201
CIF file Original IUCr paper	Formula: - C3 H4 K N3 O4 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/m 1 Cell volume: 1265.5 Cell parameters: 11.044; 16.39; 7.199; 90; 103.8; 90;

COD ID: 2103202
CIF file Original IUCr paper	Formula: - C24 H28 N8 S8 W - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3383.08 Cell parameters: 12.894; 18.666; 14.059; 90; 91.11; 90;

COD ID: 2103203
CIF file Original IUCr paper	Formula: - C22 H16 F6 N4 Ni O6 S2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 2612.04 Cell parameters: 9.941; 14.48; 18.55; 90; 101.98; 90;

COD ID: 2103204
CIF file Original IUCr paper	Formula: - C36 H34 N4 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 2834.52 Cell parameters: 30.834; 6.361; 17.283; 90; 123.26; 90;

COD ID: 2103205
CIF file Original IUCr paper	Formula: - C36 H54 O12 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: C 1 2/c 1 Cell volume: 3944.04 Cell parameters: 16.632; 14.074; 16.872; 90; 92.98; 90;

COD ID: 2103206
CIF file Original IUCr paper	Formula: - Cl4 Fe H29 Mo3 N9 O S4 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P n m a Cell volume: 2234.33 Cell parameters: 9.208; 14.948; 16.233; 90; 90; 90;

COD ID: 2103208
CIF file Original IUCr paper	Formula: - C12 H5 B F4 N O5 Re - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P n m a Cell volume: 1540.82 Cell parameters: 15.412; 7.668; 13.038; 90; 90; 90;

COD ID: 2103209
CIF file Original IUCr paper	Formula: - C23 H25 Cl3 Fe N7 O2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P n m a Cell volume: 2439.13 Cell parameters: 15.494; 12.229; 12.873; 90; 90; 90;

COD ID: 2103210
CIF file Original IUCr paper	Formula: - C8 H6 Fe2 O6 Se2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P n m a Cell volume: 1393.01 Cell parameters: 18.344; 10.544; 7.202; 90; 90; 90;

COD ID: 2103211
CIF file Original IUCr paper	Formula: ? Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 42/m Cell volume: 2284.3 Cell parameters: 15.251; 15.251; 9.821; 90; 90; 90;

COD ID: 2103212
CIF file Original IUCr paper	Formula: - C12 H10 B Mn N6 O3 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P -3 Cell volume: 912.061 Cell parameters: 11.522; 11.522; 7.933; 90; 90; 120;

COD ID: 2103213
CIF file Original IUCr paper	Formula: - C12 H10 B N6 O3 Tc - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P -3 Cell volume: 920.885 Cell parameters: 11.464; 11.464; 8.091; 90; 90; 120;

COD ID: 2103214
CIF file Original IUCr paper	Formula: - C27 H42 In N3 O9 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: R -3 :H Cell volume: 4758.14 Cell parameters: 15.447; 15.447; 23.026; 90; 90; 120;

COD ID: 2103215
CIF file Original IUCr paper	Formula: ? Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 63/m Cell volume: 3084.7 Cell parameters: 13.619; 13.619; 19.204; 90; 90; 120;

COD ID: 2103216
CIF file Original IUCr paper	Formula: - C18 H16 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/n 1 Cell volume: 612.289 Cell parameters: 7.162; 6.32; 13.647; 90; 97.6; 90;

COD ID: 2103217
CIF file Original IUCr paper	Formula: - C26 H51 O S3 Ta - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 2/c 1 Cell volume: 3057.63 Cell parameters: 9.134; 12.078; 27.74; 90; 92.39; 90;

COD ID: 2103218
CIF file Original IUCr paper	Formula: - C26 H38 O8 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/c 1 Cell volume: 1360.47 Cell parameters: 11.696; 10.45; 11.176; 90; 95.14; 90;

COD ID: 2103219
CIF file Original IUCr paper	Formula: - C24 H38 B2 F8 N4 O Pd - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/n 1 Cell volume: 2935.49 Cell parameters: 21.173; 13.096; 10.826; 90; 102.07; 90;

COD ID: 2103220
CIF file Original IUCr paper	Formula: - C8 H20 Ni P2 S2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/n 1 Cell volume: 678.785 Cell parameters: 5.897; 10.578; 10.895; 90; 92.83; 90;

COD ID: 2103221
CIF file Original IUCr paper	Formula: - C14 H30 N2 O11 Sn2 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/c 1 Cell volume: 2171.18 Cell parameters: 18.377; 7.563; 15.642; 90; 92.923; 90;

COD ID: 2103222
CIF file Original IUCr paper	Formula: - C15 H17 N O2 S - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P 1 21/c 1 Cell volume: 1375.51 Cell parameters: 11.336; 16.871; 7.287; 90; 80.748; 90;

COD ID: 2103223
CIF file Original IUCr paper	Formula: - C30 H28 Cl2 Cu2 N6 O11 - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P n m a Cell volume: 3395.07 Cell parameters: 16.763; 14.188; 14.275; 90; 90; 90;

COD ID: 2103224
CIF file Original IUCr paper	Formula: - C8 H12 Cl3 N4 S2 Sb - Comments: Marsh, Richard E.; Kapon, Moshe; Hu, Shengzhi; Herbstein, Frank H. Some 60 new space-group corrections Acta Crystallographica Section B 58(1) (2002) 62-77 Space group: P b c a Cell volume: 3125.8 Cell parameters: 9.738; 23.63; 13.584; 90; 90; 90;

COD ID: 2103225

Formula: - C16 H18 N6 O10 S -
Comments: Zaleski, J.; Daszkiewicz, Z.; Kyzioł, J. B. Structure of N,4-dinitroaniline and its complex with sulfolane at 85K; on the proton donor‒acceptor affinity of the primary nitramine (HNNO~2~) group Acta Crystallographica Section B 58(1) (2002) 109-115
Space group: P 1 21/n 1
Cell volume: 2013
Cell parameters: 10.043; 17.131; 12.299; 90; 107.95; 90;

COD ID: 2103226

Formula: - C6 H5 N3 O4 -
Comments: Zaleski, J.; Daszkiewicz, Z.; Kyzioł, J. B. Structure of N,4-dinitroaniline and its complex with sulfolane at 85K; on the proton donor‒acceptor affinity of the primary nitramine (HNNO~2~) group Acta Crystallographica Section B 58(1) (2002) 109-115
Space group: P -1
Cell volume: 724.7
Cell parameters: 6.947; 7.773; 13.836; 84.25; 79.77; 81.27;

COD ID: 2103227

Formula: - C12 H9 I N2 O4 S -
Comments: Kelly, Craig J.; Skakle, Janet M. S.; Wardell, James L.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher Iodo-nitroarenesulfonamides: interplay of hard and soft hydrogen bonds, I···O interactions and aromatic π···π stacking interactions Acta Crystallographica Section B 58(1) (2002) 94-108
Space group: P 1 21/n 1
Cell volume: 1361.85
Cell parameters: 5.0825; 13.0448; 20.5648; 90; 92.7786; 90;

COD ID: 2103228

Formula: - C12 H9 I N2 O4 S -
Comments: Kelly, Craig J.; Skakle, Janet M. S.; Wardell, James L.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher Iodo-nitroarenesulfonamides: interplay of hard and soft hydrogen bonds, I···O interactions and aromatic π···π stacking interactions Acta Crystallographica Section B 58(1) (2002) 94-108
Space group: C 1 c 1
Cell volume: 1362.1
Cell parameters: 5.0246; 13.0735; 20.884; 90; 96.835; 90;

COD ID: 2103229

Formula: - C18 H12 I N3 O8 S2 -
Comments: Kelly, Craig J.; Skakle, Janet M. S.; Wardell, James L.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher Iodo-nitroarenesulfonamides: interplay of hard and soft hydrogen bonds, I···O interactions and aromatic π···π stacking interactions Acta Crystallographica Section B 58(1) (2002) 94-108
Space group: C 1 2/c 1
Cell volume: 2101.91
Cell parameters: 18.1057; 11.3671; 11.1174; 90; 113.272; 90;

COD ID: 2103230

Formula: - C12 H9 I N2 O4 S -
Comments: Kelly, Craig J.; Skakle, Janet M. S.; Wardell, James L.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher Iodo-nitroarenesulfonamides: interplay of hard and soft hydrogen bonds, I···O interactions and aromatic π···π stacking interactions Acta Crystallographica Section B 58(1) (2002) 94-108
Space group: P -1
Cell volume: 675.58
Cell parameters: 7.6482; 8.4274; 10.879; 88.8029; 75.8302; 83.5777;

COD ID: 2103231

Formula: - C13 H11 I N2 O4 S -
Comments: Kelly, Craig J.; Skakle, Janet M. S.; Wardell, James L.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher Iodo-nitroarenesulfonamides: interplay of hard and soft hydrogen bonds, I···O interactions and aromatic π···π stacking interactions Acta Crystallographica Section B 58(1) (2002) 94-108
Space group: P -1
Cell volume: 726.52
Cell parameters: 5.4333; 10.9336; 12.5713; 95.5668; 93.0809; 101.423;

COD ID: 2103232

Formula: - C12 H9 I N2 O4 S -
Comments: Kelly, Craig J.; Skakle, Janet M. S.; Wardell, James L.; Wardell, Solange M. S. V.; Low, John N.; Glidewell, Christopher Iodo-nitroarenesulfonamides: interplay of hard and soft hydrogen bonds, I···O interactions and aromatic π···π stacking interactions Acta Crystallographica Section B 58(1) (2002) 94-108
Space group: P -1
Cell volume: 1349.76
Cell parameters: 8.1228; 13.0723; 14.4738; 113.471; 100.718; 97.3706;

COD ID: 2103233

Formula: - C32 H38 N4 Ni O4 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: P 1 21/c 1
Cell volume: 1461.83
Cell parameters: 11.497; 10.6563; 11.9407; 90; 92.208; 90;

COD ID: 2103234

Formula: - C24 H30 N8 Ni O12 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: P -1
Cell volume: 723.3
Cell parameters: 7.7663; 9.7845; 10.4026; 99.826; 97.966; 108.388;

COD ID: 2103235

Formula: - C24 H32 N6 Ni O8 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: P 1 21/n 1
Cell volume: 1262.51
Cell parameters: 12.8106; 8.4187; 12.8397; 90; 114.254; 90;

COD ID: 2103236

Formula: - C24 H34 N4 Ni O6 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: P 1 21/c 1
Cell volume: 1192.74
Cell parameters: 8.518; 13.2496; 10.772; 90; 101.161; 90;

COD ID: 2103237

Formula: - C24 H36 N6 Ni O4 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: C 1 2/c 1
Cell volume: 2485.27
Cell parameters: 18.443; 8.4149; 16.8262; 90; 107.877; 90;

COD ID: 2103238

Formula: - C18 H38 N4 Ni O10 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: C 1 c 1
Cell volume: 2385.61
Cell parameters: 18.4057; 9.6927; 13.4648; 90; 96.724; 90;

COD ID: 2103239

Formula: - C18 H30 N4 Ni O5 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: C 1 2/c 1
Cell volume: 2033.14
Cell parameters: 16.2155; 16.0404; 8.8937; 90; 118.49; 90;

COD ID: 2103240

Formula: - C40 H79.72 Cl2 N12 Ni3 O18.86 -
Comments: Zakaria, Choudhury M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher [Ni(cyclam)(OCOR)~2~], a finite molecular complex: hydrogen-bonded supramolecular aggregation in one, two and three dimensions, and coordination polymers in one and two dimensions Acta Crystallographica Section B 58(1) (2002) 78-93
Space group: P 1 21/c 1
Cell volume: 2739.13
Cell parameters: 10.8295; 16.9416; 14.9596; 90; 93.626; 90;

COD ID: 2103241

Formula: - C12 H9 Cl O -
Comments: Lehmler, Hans-Joachim; Robertson, Larry W.; Parkin, Sean; Brock, Carolyn Pratt Z' = 4 structure without obvious pseudosymmetry: implications for the formation of solid-state compounds Acta Crystallographica, Section B: Structural Science 58(1) (2002) 140-147
Space group: P 1 21/c 1
Cell volume: 4132.5
Cell parameters: 17.418; 12.015; 19.841; 90; 95.59; 90;

COD ID: 2103242

Formula: - C12 H9 Cl O -
Comments: Lehmler, Hans-Joachim; Robertson, Larry W.; Parkin, Sean; Brock, Carolyn Pratt Z' = 4 structure without obvious pseudosymmetry: implications for the formation of solid-state compounds Acta Crystallographica, Section B: Structural Science 58(1) (2002) 140-147
Space group: P 1 21/c 1
Cell volume: 4017.8
Cell parameters: 17.211; 11.962; 19.621; 90; 95.95; 90;

COD ID: 2103243

Formula: - C12 H36 Si Sn4 -
Comments: Dinnebier, Robert E.; Bernatowicz, Piotr; Helluy, Xavier; Sebald, Angelika; Wunschel, Markus; Fitch, Andy; van Smaalen, Sander Structure of compounds E(SnMe~3~)~4~ (E = Si, Ge) as seen by high-resolution X-ray powder diffraction and solid-state NMR Acta Crystallographica Section B 58(1) (2002) 52-61
Space group: P -1
Cell volume: 1222.04
Cell parameters: 9.92009; 14.5103; 9.13585; 90.4769; 111.672; 89.9877;

COD ID: 2103244

Formula: - C12 H36 Ge Sn4 -
Comments: Dinnebier, Robert E.; Bernatowicz, Piotr; Helluy, Xavier; Sebald, Angelika; Wunschel, Markus; Fitch, Andy; van Smaalen, Sander Structure of compounds E(SnMe~3~)~4~ (E = Si, Ge) as seen by high-resolution X-ray powder diffraction and solid-state NMR Acta Crystallographica Section B 58(1) (2002) 52-61
Space group: P -1
Cell volume: 1229.41
Cell parameters: 9.94457; 14.52927; 9.16021; 90.5339; 111.731; 90.0049;

COD ID: 2103245
CIF file Original IUCr paper	Formula: - Ta - Comments: Arakcheeva, Alla; Chapuis, Gervais; Grinevitch, Vladimir The self-hosting structure of β-Ta Acta Crystallographica Section B 58(1) (2002) 1-7 Space group: P -4 21 m Cell volume: 553.3 Cell parameters: 10.211; 10.211; 5.3064; 90; 90; 90;

COD ID: 2103246
CIF file Original IUCr paper	Formula: - C26 H31 N O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P -1 Cell volume: 1113.1 Cell parameters: 6.234; 10.934; 16.974; 84.98; 81.29; 77.1;

COD ID: 2103247
CIF file Original IUCr paper	Formula: - C30 H36.5 N1.5 O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P -1 Cell volume: 1255.33 Cell parameters: 7.8594; 10.015; 17.169; 78.909; 85.161; 71.238;

COD ID: 2103248
CIF file Original IUCr paper	Formula: - C38 H47.5 N2.5 O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P -1 Cell volume: 3254.6 Cell parameters: 7.885; 10.026; 43.761; 94.661; 91.539; 109.02;

COD ID: 2103249
CIF file Original IUCr paper	Formula: - C42 H53 N3 O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P 1 21/n 1 Cell volume: 7374.6 Cell parameters: 9.807; 25.464; 29.842; 90; 98.28; 90;

COD ID: 2103250
CIF file Original IUCr paper	Formula: - C22 H25.5 N0.5 O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: C 1 2/c 1 Cell volume: 3598.5 Cell parameters: 18.1704; 12.2744; 16.2036; 90; 95.3; 90;

COD ID: 2103251
CIF file Original IUCr paper	Formula: - C34 H42 N2 O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P -1 Cell volume: 1429.57 Cell parameters: 6.3593; 10.8368; 21.7366; 93.429; 91.1; 106.912;

COD ID: 2103252
CIF file Original IUCr paper	Formula: - C22 H27.5 N0.5 O3 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P -1 Cell volume: 1872.93 Cell parameters: 10.8979; 12.5017; 15.1701; 106.51; 99.895; 102.559;

COD ID: 2103253
CIF file Original IUCr paper	Formula: - C26 H31 N O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: C 1 2/c 1 Cell volume: 4328.5 Cell parameters: 34.965; 6.2546; 20.2035; 90; 101.577; 90;

COD ID: 2103254
CIF file Original IUCr paper	Formula: - C26 H31 N O2 - Comments: Nassimbeni, Luigi R.; Su, Hong Inclusion compounds of a diol host with xylidines: controlled stoichiometries Acta Crystallographica Section B 58(2) (2002) 251-259 Space group: P -1 Cell volume: 1101.1 Cell parameters: 6.327; 10.72; 16.92; 96.481; 100.094; 99.827;

COD ID: 2103255

Formula: - C27 H46 O -
Comments: Hsu, Leh-Yeh; Kampf, Jeff W.; Nordman, Christer E. Structure and pseudosymmetry of cholesterol at 310K Acta Crystallographica Section B 58(2) (2002) 260-264
Space group: P 1
Cell volume: 10151
Cell parameters: 27.565; 38.624; 10.748; 93.49; 90.9; 117.15;

COD ID: 2103256

Formula: - Bi Co2 O8.25 Sr3 -
Comments: Perez, O.; Masset, A. C.; Leligny, H.; Baldinozzi, G.; Pelloquin, D.; Dutheil, M. Single-crystal study of the m = 2 tubular cobalt oxide, Bi~4~Sr~12~Co~8~O~30{-~δ} Acta Crystallographica Section B 58(2) (2002) 191-197
Space group: C 2 2 2
Cell volume: 3042.14
Cell parameters: 23.4782; 23.4857; 5.5171; 90; 90; 90;

COD ID: 2103257

Formula: - La1.14 Nb S3.14 -
Comments: Jobst, Andreas; van Smaalen, Sander Intersubsystem chemical bonds in the misfit layer compounds (LaS)~1.13~TaS~2~ and (LaS)~1.14~NbS~2~ Acta Crystallographica Section B 58(2) (2002) 179-190
Space group:
Cell volume: 440.021
Cell parameters: 3.3065; 5.7972; 22.9555; 90; 90; 90;

COD ID: 2103258

Formula: - La1.13 S3.13 Ta -
Comments: Jobst, Andreas; van Smaalen, Sander Intersubsystem chemical bonds in the misfit layer compounds (LaS)~1.13~TaS~2~ and (LaS)~1.14~NbS~2~ Acta Crystallographica Section B 58(2) (2002) 179-190
Space group:
Cell volume: 437.74
Cell parameters: 3.2923; 5.7776; 23.013; 90; 90; 90;

COD ID: 2103259

Formula: - C22 H24 N2 O8 -
Comments: Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (R,R)-O,O'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (R,R)-O,O'-dibenzoyltartaric acid diamide Acta Crystallographica Section B 58(2) (2002) 265-271
Space group: C 2 2 21
Cell volume: 2194.9
Cell parameters: 5.253; 26.748; 15.621; 90; 90; 90;

COD ID: 2103260

Formula: - C20 H20 N2 O6 -
Comments: Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (R,R)-O,O'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (R,R)-O,O'-dibenzoyltartaric acid diamide Acta Crystallographica Section B 58(2) (2002) 265-271
Space group: P 21 21 2
Cell volume: 951.8
Cell parameters: 10.282; 18.024; 5.136; 90; 90; 90;

COD ID: 2103261

Formula: - C23 H21 N3 O6 -
Comments: Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (R,R)-O,O'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (R,R)-O,O'-dibenzoyltartaric acid diamide Acta Crystallographica Section B 58(2) (2002) 265-271
Space group: C 1 2 1
Cell volume: 2241.9
Cell parameters: 27.898; 5.145; 15.648; 90; 93.49; 90;

COD ID: 2103262

Formula: - C20 H18 O8 -
Comments: Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (R,R)-O,O'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (R,R)-O,O'-dibenzoyltartaric acid diamide Acta Crystallographica Section B 58(2) (2002) 265-271
Space group: P 21 21 2
Cell volume: 945.7
Cell parameters: 9.462; 17.653; 5.662; 90; 90; 90;

COD ID: 2103263

Formula: - C20 H19 N O7 -
Comments: Rychlewska, Urszula; Warżajtis, Beata Isostructuralism in a series of methylester/methylamide derivatives of (R,R)-O,O'-dibenzoyl tartaric acid; inclusion properties and guest-dependent homeotypism of the crystals of (R,R)-O,O'-dibenzoyltartaric acid diamide Acta Crystallographica Section B 58(2) (2002) 265-271
Space group: P 21 21 2
Cell volume: 925.1
Cell parameters: 9.898; 17.756; 5.264; 90; 90; 90;

COD ID: 2103264

Formula: - C16 H16 N2 O6 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P -1
Cell volume: 755.51
Cell parameters: 8.878; 9.613; 10.102; 73.665; 66.433; 79.141;

COD ID: 2103265

Formula: - C32 H32 N4 O12 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P 1
Cell volume: 742.22
Cell parameters: 8.6195; 9.5654; 9.8727; 103.162; 109.912; 90.262;

COD ID: 2103266

Formula: - C14 H14 N2 O6 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P -1
Cell volume: 665.26
Cell parameters: 4.7847; 10.2505; 13.8412; 99.434; 91.252; 96.163;

COD ID: 2103267

Formula: - C14 H14 N2 O6 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P 1 21 1
Cell volume: 657.27
Cell parameters: 10.443; 4.4665; 14.11; 90; 92.954; 90;

COD ID: 2103268

Formula: - C8 H16 N2 O6 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P 1 21 1
Cell volume: 515.7
Cell parameters: 6.4043; 9.086; 9.3734; 90; 109.006; 90;

COD ID: 2103269

Formula: - C12 H22 N2 O12 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P 1 21/n 1
Cell volume: 776.34
Cell parameters: 6.5439; 15.7915; 7.5357; 90; 94.484; 90;

COD ID: 2103270

Formula: - C14 H24 N2 O12 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P 1 21/n 1
Cell volume: 877.67
Cell parameters: 7.324; 15.9935; 7.5149; 90; 94.405; 90;

COD ID: 2103271

Formula: - C34 H60 N6 O24 -
Comments: Farrell, Dorcas M. M.; Ferguson, George; Lough, Alan J.; Glidewell, Christopher Chiral versus racemic building blocks in supramolecular chemistry: tartrate salts of organic diamines Acta Crystallographica Section B 58(2) (2002) 272-288
Space group: P 21 21 21
Cell volume: 4062.13
Cell parameters: 8.8886; 10.0973; 45.2601; 90; 90; 90;

COD ID: 2103272

Formula: - C16 H8 N2 O4 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P n a 21
Cell volume: 1504.75
Cell parameters: 7.1298; 30.7247; 6.8691; 90; 90; 90;

COD ID: 2103273

Formula: - C16 H8 N2 O4 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P 1 21/c 1
Cell volume: 3067.73
Cell parameters: 13.5052; 7.874; 29.205; 90; 98.964; 90;

COD ID: 2103274

Formula: - C17 H11 N3 O6 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P 1 21/c 1
Cell volume: 1786.4
Cell parameters: 22.5545; 4.8545; 16.7095; 90; 102.467; 90;

COD ID: 2103275

Formula: - C19 H10.5 Cl0.5 N2 O4 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P -1
Cell volume: 874.59
Cell parameters: 7.6257; 10.3369; 11.6392; 81.544; 77.86; 78.848;

COD ID: 2103276

Formula: - C19.652 H12.652 N2 O4.043 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P 1 21/c 1
Cell volume: 3636.35
Cell parameters: 13.76; 16.4924; 16.045; 90; 92.951; 90;

COD ID: 2103277

Formula: - C16 H8 N2 O4 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: C 1 2/c 1
Cell volume: 1769.92
Cell parameters: 14.418; 16.0502; 7.6616; 90; 93.369; 90;

COD ID: 2103278
CIF file Original IUCr paper	Formula: - C16 H8 N2 O4 S2 - Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of <i>N</i>,<i>N</i>'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299 Space group: C 1 2/c 1 Cell volume: 1744 Cell parameters: 14.3752; 15.9349; 7.631; 90; 93.845; 90;

COD ID: 2103279

Formula: - C20 H13 N2 O4 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P 1 21/n 1
Cell volume: 1791.52
Cell parameters: 14.2629; 16.1851; 7.7835; 90; 94.3917; 90;

COD ID: 2103280

Formula: - C19.5 H12 N2 O4 S2 -
Comments: Farrell, Dorcas M. M.; Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Zakaria, Choudhury M. Polymorphs and pseudopolymorphs of N,N'-dithiobisphthalimide Acta Crystallographica Section B 58(2) (2002) 289-299
Space group: P 1 21/n 1
Cell volume: 1772.03
Cell parameters: 14.3126; 16.127; 7.699; 90; 94.3216; 90;

COD ID: 2103281

Formula: - C18 H17 N5 O2 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1 21/n 1
Cell volume: 3270.7
Cell parameters: 11.677; 13.362; 21.478; 90; 102.58; 90;

COD ID: 2103282

Formula: - C15 H17 N5 O4 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P -1
Cell volume: 780.06
Cell parameters: 7.3525; 7.542; 14.9454; 91.797; 100.467; 106.102;

COD ID: 2103283

Formula: - C16 H19 N5 O4 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1 21/c 1
Cell volume: 1573.7
Cell parameters: 5.2399; 31.163; 9.792; 90; 100.2; 90;

COD ID: 2103284

Formula: - C16 H19 N5 O4 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1 21 1
Cell volume: 1682.14
Cell parameters: 7.483; 16.611; 13.5378; 90; 91.542; 90;

COD ID: 2103285

Formula: - C22 H23 N5 O4 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1
Cell volume: 1046.22
Cell parameters: 7.9899; 8.4278; 17.0042; 99.91; 90.561; 111.488;

COD ID: 2103286

Formula: - C23 H25 N5 O4 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P -1
Cell volume: 2154.96
Cell parameters: 8.6595; 16.3567; 16.9014; 105.221; 104.696; 100.372;

COD ID: 2103287

Formula: - C25 H22 N4 O3 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1 21/n 1
Cell volume: 2088.45
Cell parameters: 14.6856; 7.7726; 18.5721; 90; 99.8847; 90;

COD ID: 2103288

Formula: - C25 H22 N4 O3 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1 21/c 1
Cell volume: 2146.54
Cell parameters: 13.8074; 15.8175; 10.2119; 90; 105.749; 90;

COD ID: 2103289

Formula: - C18 H17 N3 O2 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: C 1 2/c 1
Cell volume: 3078.36
Cell parameters: 32.4902; 7.5034; 12.7804; 90; 98.879; 90;

COD ID: 2103290

Formula: - C12 H19.1 N6 O1.55 -
Comments: Quesada, Antonio; Marchal, Antonio; Melguizo, Manuel; Nogueras, Manuel; Sánchez, Adolfo; Low, John N.; Cannon, Debbie; Farrell, Dorcas M. M.; Glidewell, Christopher Amino-substituted O^6^-benzyl-5-nitrosopyrimidines: interplay of molecular, molecular-electronic and supramolecular structures Acta Crystallographica Section B 58(2) (2002) 300-315
Space group: P 1 21/n 1
Cell volume: 2689.49
Cell parameters: 18.4687; 8.1067; 19.188; 90; 110.58; 90;

COD ID: 2103291

Formula: - C42 H42 Cl2 P2 Pt -
Comments: Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke Structures of trans-[PtCl~2~(PBz~3~)~2~], trans-[PtI~2~(PBz~3~)~2~], trans-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and trans-[PdI~2~(PBz~3~)~2~] Acta Crystallographica Section B 58(2) (2002) 244-250
Space group: P -1
Cell volume: 1878.3
Cell parameters: 9.4657; 10.609; 19.018; 82.5; 82.75; 88.59;

COD ID: 2103292

Formula: - C42 H42 I2 P2 Pt -
Comments: Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke Structures of trans-[PtCl~2~(PBz~3~)~2~], trans-[PtI~2~(PBz~3~)~2~], trans-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and trans-[PdI~2~(PBz~3~)~2~] Acta Crystallographica Section B 58(2) (2002) 244-250
Space group: P 1 n 1
Cell volume: 1967.3
Cell parameters: 11.256; 9.985; 18.126; 90; 105.05; 90;

COD ID: 2103293

Formula: - C47 H45 N2 P2 Pt S2 -
Comments: Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke Structures of trans-[PtCl~2~(PBz~3~)~2~], trans-[PtI~2~(PBz~3~)~2~], trans-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and trans-[PdI~2~(PBz~3~)~2~] Acta Crystallographica Section B 58(2) (2002) 244-250
Space group: P -1
Cell volume: 2109.8
Cell parameters: 9.5006; 11.8; 19.112; 83.99; 89.87; 81.98;

COD ID: 2103294

Formula: - C42 H42 I2 P2 Pd -
Comments: Johansson, Maria H.; Otto, Stefanus; Oskarsson, Åke Structures of trans-[PtCl~2~(PBz~3~)~2~], trans-[PtI~2~(PBz~3~)~2~], trans-[Pt(NCS)~2~(PBz~3~)~2~]·0.5C~6~H~6~ and trans-[PdI~2~(PBz~3~)~2~] Acta Crystallographica Section B 58(2) (2002) 244-250
Space group: P 1 n 1
Cell volume: 1968
Cell parameters: 11.274; 9.994; 18.073; 90; 104.88; 90;

COD ID: 2103295
CIF file Original IUCr paper	Formula: - Bi0.5 Na0.5 O3 Ti - Comments: Jones, G. O.; Thomas, P. A. Investigation of the structure and phase transitions in the novel A-site substituted distorted perovskite compound Na~0.5~Bi~0.5~TiO~3~ Acta Crystallographica Section B 58(2) (2002) 168-178 Space group: R 3 c :H Cell volume: 352.34 Cell parameters: 5.4887; 5.4887; 13.5048; 90; 90; 120;

COD ID: 2103296
CIF file Original IUCr paper	Formula: - Bi0.5 Na0.5 O3 Ti - Comments: Jones, G. O.; Thomas, P. A. Investigation of the structure and phase transitions in the novel A-site substituted distorted perovskite compound Na~0.5~Bi~0.5~TiO~3~ Acta Crystallographica Section B 58(2) (2002) 168-178 Space group: P 4 b m Cell volume: 118.966 Cell parameters: 5.5179; 5.5179; 3.9073; 90; 90; 90;

COD ID: 2103297
CIF file Original IUCr paper	Formula: - Bi0.5 Na0.5 O3 Ti - Comments: Jones, G. O.; Thomas, P. A. Investigation of the structure and phase transitions in the novel A-site substituted distorted perovskite compound Na~0.5~Bi~0.5~TiO~3~ Acta Crystallographica Section B 58(2) (2002) 168-178 Space group: P m -3 m Cell volume: 59.9454 Cell parameters: 3.91368; 3.91368; 3.91368; 90; 90; 90;

COD ID: 2103298

Formula: - C16 H22 Br0.39 Cl0.61 Co N6 O4 -
Comments: Vithana, Champika; Uekusa, Hidehiro; Sekine, Akiko; Ohashi, Yuji Modified photoreactivity due to mixed crystal formation. I. Three mixed crystals between isostructural cobaloxime complexes Acta Crystallographica Section B 58(2) (2002) 227-232
Space group: P 1 21/a 1
Cell volume: 1986.2
Cell parameters: 23.818; 9.451; 8.8553; 90; 94.842; 90;

COD ID: 2103299

Formula: - C16.565 H23.695 Cl0.435 Co N6 O4 -
Comments: Vithana, Champika; Uekusa, Hidehiro; Sekine, Akiko; Ohashi, Yuji Modified photoreactivity due to mixed crystal formation. I. Three mixed crystals between isostructural cobaloxime complexes Acta Crystallographica Section B 58(2) (2002) 227-232
Space group: P 1 21/a 1
Cell volume: 1982.5
Cell parameters: 23.751; 9.468; 8.8453; 90; 94.672; 90;

COD ID: 2103300

Formula: - C16.518 H19.572 Cl0.476 Co N6 O4 -
Comments: Vithana, Champika; Uekusa, Hidehiro; Sekine, Akiko; Ohashi, Yuji Modified photoreactivity due to mixed crystal formation. I. Three mixed crystals between isostructural cobaloxime complexes Acta Crystallographica Section B 58(2) (2002) 227-232
Space group: P 1 21/a 1
Cell volume: 1995.4
Cell parameters: 23.7797; 9.5032; 8.8569; 90; 94.479; 90;

COD ID: 2103301

Formula: - C16.55 H23.64 Br0.45 Co N6 O4 -
Comments: Vithana, Champika; Uekusa, Hidehiro; Sekine, Akiko; Ohashi, Yuji Modified photoreactivity due to mixed crystal formation. I. Three mixed crystals between isostructural cobaloxime complexes Acta Crystallographica Section B 58(2) (2002) 227-232
Space group: P 1 21/a 1
Cell volume: 1994
Cell parameters: 23.82; 9.52; 8.822; 90; 94.73; 90;

COD ID: 2103302

Formula: - C7 H8 O2 -
Comments: Yufit, D. S.; Kozhushkov, S. I.; Howard, J. A. K.; de Meijere, A. Crystal structure of 5-oxatricyclo[5.1.0.0^1,3^]octane-4-one: two polymorphs in one crystal Acta Crystallographica Section B 58(4) (2002) 673-676
Space group: P 21 21 21
Cell volume: 607.01
Cell parameters: 9.9644; 8.1854; 7.4422; 90; 90; 90;

COD ID: 2103303

Formula: - C7 H8 O2 -
Comments: Yufit, D. S.; Kozhushkov, S. I.; Howard, J. A. K.; de Meijere, A. Crystal structure of 5-oxatricyclo[5.1.0.0^1,3^]octane-4-one: two polymorphs in one crystal Acta Crystallographica Section B 58(4) (2002) 673-676
Space group: P 1 21/c 1
Cell volume: 603.08
Cell parameters: 9.9533; 8.1831; 7.8129; 90; 108.61; 90;

COD ID: 2103304

Formula: - C13 H13 N3 O2 -
Comments: Cole, Jacqueline M.; Goeta, Andrés E.; Howard, Judith A. K.; McIntyre, Garry J. X-ray and neutron diffraction studies of the non-linear optical compounds MBANP and MBADNP at 20K: charge-density and hydrogen-bonding analyses Acta Crystallographica Section B 58(4) (2002) 690-700
Space group: P 1 21 1
Cell volume: 589.8
Cell parameters: 5.321; 6.293; 17.65; 90; 93.65; 90;

COD ID: 2103305

Formula: - C13 H12 N4 O4 -
Comments: Cole, Jacqueline M.; Goeta, Andrés E.; Howard, Judith A. K.; McIntyre, Garry J. X-ray and neutron diffraction studies of the non-linear optical compounds MBANP and MBADNP at 20K: charge-density and hydrogen-bonding analyses Acta Crystallographica Section B 58(4) (2002) 690-700
Space group: P 1 21 1
Cell volume: 636.1
Cell parameters: 8.352; 8.57; 8.909; 90; 93.98; 90;

COD ID: 2103306

COD ID: 2103307
CIF file Original IUCr paper	Formula: - C2 H5 N O2 - Comments: Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B 58(4) (2002) 728-733 Space group: P 1 21/n 1 Cell volume: 308.78 Cell parameters: 5.0993; 11.9416; 5.4608; 90; 111.784; 90;

COD ID: 2103308
CIF file Original IUCr paper	Formula: - C2 H5 N O2 - Comments: Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B 58(4) (2002) 728-733 Space group: P 1 21/n 1 Cell volume: 309 Cell parameters: 5.0999; 11.9516; 5.4594; 90; 111.781; 90;

COD ID: 2103309
CIF file Original IUCr paper	Formula: - C2 H5 N O2 - Comments: Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B 58(4) (2002) 728-733 Space group: P 1 21/n 1 Cell volume: 309.23 Cell parameters: 5.1008; 11.9558; 5.4602; 90; 111.772; 90;

COD ID: 2103310
CIF file Original IUCr paper	Formula: - C2 H5 N O2 - Comments: Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B 58(4) (2002) 728-733 Space group: P 1 21/n 1 Cell volume: 309.53 Cell parameters: 5.1012; 11.9651; 5.4604; 90; 111.763; 90;

COD ID: 2103311
CIF file Original IUCr paper	Formula: - C2 H5 N O2 - Comments: Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B 58(4) (2002) 728-733 Space group: P 1 21/n 1 Cell volume: 309.88 Cell parameters: 5.1026; 11.9752; 5.4602; 90; 111.757; 90;

COD ID: 2103312
CIF file Original IUCr paper	Formula: - C2 H5 N O2 - Comments: Langan, Paul; Mason, Sax A.; Myles, Dean; Schoenborn, Benno P. Structural characterization of crystals of α-glycine during anomalous electrical behaviour Acta Crystallographica Section B 58(4) (2002) 728-733 Space group: P 1 21/n 1 Cell volume: 312.63 Cell parameters: 5.1074; 12.0775; 5.4596; 90; 111.827; 90;

COD ID: 2103313
CIF file Original IUCr paper	Formula: - Ge Li O5 Ta - Comments: Malcherek, Thomas Structure and phase transitions of LiTaOGeO~4~ Acta Crystallographica Section B 58(4) (2002) 607-612 Space group: P 1 21/c 1 Cell volume: 399.9 Cell parameters: 7.584; 8.0849; 7.508; 90; 119.69; 90;

COD ID: 2103314

Formula: - Ge Li O5 Ta -
Comments: Malcherek, Thomas Structure and phase transitions of LiTaOGeO~4~ Acta Crystallographica Section B 58(4) (2002) 607-612
Space group: C 1 2/c 1
Cell volume: 400.913
Cell parameters: 7.5773; 8.1188; 7.491; 90; 119.545; 90;

COD ID: 2103315

COD ID: 2103316

Formula: - Ca2 O4 Si -
Comments: Toraya, H.; Yamazaki, S. Simulated annealing structure solution of a new phase of dicalcium silicate Ca~2~SiO~4~ and the mechanism of structural changes from α-dicalcium silicate hydrate to α~L~'-dicalcium silicate via the new phase Acta Crystallographica Section B 58(4) (2002) 613-621
Space group: P 1 21/c 1
Cell volume: 785
Cell parameters: 8.2127; 9.793; 9.7954; 90; 94.848; 90;

COD ID: 2103317

Formula: - C27 H44 O6 -
Comments: Fábián, László; Argay, Gyula; Kálmán, Alajos; Báthori, Mária Crystal structures of ecdysteroids: the role of solvent molecules in hydrogen bonding and isostructurality Acta Crystallographica Section B 58(4) (2002) 710-720
Space group: P 21 21 21
Cell volume: 2745.5
Cell parameters: 7.75; 9.935; 35.657; 90; 90; 90;

COD ID: 2103318

Formula: - C27 H44 O7 -
Comments: Fábián, László; Argay, Gyula; Kálmán, Alajos; Báthori, Mária Crystal structures of ecdysteroids: the role of solvent molecules in hydrogen bonding and isostructurality Acta Crystallographica Section B 58(4) (2002) 710-720
Space group: P 21 21 21
Cell volume: 2672.4
Cell parameters: 7.663; 10.541; 33.084; 90; 90; 90;

COD ID: 2103319

Formula: - C28 H50 O9 -
Comments: Fábián, László; Argay, Gyula; Kálmán, Alajos; Báthori, Mária Crystal structures of ecdysteroids: the role of solvent molecules in hydrogen bonding and isostructurality Acta Crystallographica Section B 58(4) (2002) 710-720
Space group: P 21 21 21
Cell volume: 2879.8
Cell parameters: 7.167; 9.703; 41.412; 90; 90; 90;

COD ID: 2103320

Formula: - C27 H50 O10 -
Comments: Fábián, László; Argay, Gyula; Kálmán, Alajos; Báthori, Mária Crystal structures of ecdysteroids: the role of solvent molecules in hydrogen bonding and isostructurality Acta Crystallographica Section B 58(4) (2002) 710-720
Space group: P 21 21 21
Cell volume: 3002.5
Cell parameters: 11.293; 14.202; 18.721; 90; 90; 90;

COD ID: 2103321

Formula: - C27 H46 O9 -
Comments: Fábián, László; Argay, Gyula; Kálmán, Alajos; Báthori, Mária Crystal structures of ecdysteroids: the role of solvent molecules in hydrogen bonding and isostructurality Acta Crystallographica Section B 58(4) (2002) 710-720
Space group: P 21 21 21
Cell volume: 2749.4
Cell parameters: 7.163; 10.303; 37.254; 90; 90; 90;

COD ID: 2103322

Formula: - C18 H26 N6 O12 -
Comments: Saraswathi, N.T.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XXXIX. Crystal structures of malonic acid complexes of DL- and L-histidine. Preservation of aggregation pattern on reversal of chirality Acta Crystallographica Section B 58(4) (2002) 734-739
Space group: P 1 21/n 1
Cell volume: 1122.8
Cell parameters: 5.3643; 25.3538; 8.3043; 90; 96.202; 90;

COD ID: 2103323

Formula: - C18 H26 N6 O12 -
Comments: Saraswathi, N.T.; Vijayan, M. X-ray studies on crystalline complexes involving amino acids and peptides. XXXIX. Crystal structures of malonic acid complexes of DL- and L-histidine. Preservation of aggregation pattern on reversal of chirality Acta Crystallographica Section B 58(4) (2002) 734-739
Space group: P 1 21 1
Cell volume: 1113.1
Cell parameters: 5.3287; 25.534; 8.2421; 90; 97; 90;

COD ID: 2103324

Formula: - C22 H36 N6 O7 -
Comments: Dittrich, B.; Koritsánszky, T.; Grosche, M.; Scherer, W.; Flaig, R.; Wagner, A.; Krane, H. G.; Kessler, H.; Riemer, C.; Schreurs, A. M. M.; Luger, P. Reproducability and transferability of topological properties; experimental charge density of the hexapeptide cyclo-(D,L-Pro)_2‒(L-Ala)_4 monohydrate Acta Crystallographica Section B 58(4) (2002) 721-727
Space group: P 21 21 21
Cell volume: 2466.8
Cell parameters: 10.128; 12.486; 19.507; 90; 90; 90;

COD ID: 2103325

Formula: - C22 H36 N6 O7 -
Comments: Dittrich, B.; Koritsánszky, T.; Grosche, M.; Scherer, W.; Flaig, R.; Wagner, A.; Krane, H. G.; Kessler, H.; Riemer, C.; Schreurs, A. M. M.; Luger, P. Reproducability and transferability of topological properties; experimental charge density of the hexapeptide cyclo-(D,L-Pro)_2‒(L-Ala)_4 monohydrate Acta Crystallographica Section B 58(4) (2002) 721-727
Space group: P 21 21 21
Cell volume: 2468
Cell parameters: 10.127; 12.501; 19.495; 90; 90; 90;

COD ID: 2103326

Formula: - C6 H5 I N2 O2 -
Comments: Garden, Simon J.; Fontes, Silvia P.; Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher Interplay of hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions in iodo-nitroanilines Acta Crystallographica Section B 58(4) (2002) 701-709
Space group: P -1
Cell volume: 376.96
Cell parameters: 6.4236; 7.4979; 8.293; 71.422; 85.285; 86.125;

COD ID: 2103327

Formula: - C6 H5 I N2 O2 -
Comments: Garden, Simon J.; Fontes, Silvia P.; Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher Interplay of hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions in iodo-nitroanilines Acta Crystallographica Section B 58(4) (2002) 701-709
Space group: C 1 2/c 1
Cell volume: 3017.47
Cell parameters: 26.5541; 7.0445; 16.4416; 90; 101.155; 90;

COD ID: 2103328

Formula: - C6 H4 I2 N2 O2 -
Comments: Garden, Simon J.; Fontes, Silvia P.; Wardell, James L.; Skakle, Janet M. S.; Low, John N.; Glidewell, Christopher Interplay of hydrogen bonds, iodo···nitro interactions and aromatic π···π stacking interactions in iodo-nitroanilines Acta Crystallographica Section B 58(4) (2002) 701-709
Space group: P 1 21/c 1
Cell volume: 940.95
Cell parameters: 7.6069; 12.5917; 10.2546; 90; 106.669; 90;

COD ID: 2103329

Formula: - C9 H12 O -
Comments: Wójcik, Grażyna; Holband, Jolanta Variable-temperature studies of the 4-isopropylphenol crystal structure from X-ray diffraction. Comparison of thermal expansion and molecular dynamics with spectroscopic results Acta Crystallographica Section B 58(4) (2002) 684-689
Space group: P 41
Cell volume: 793.3
Cell parameters: 9.848; 9.864; 8.166; 90; 90; 90;

COD ID: 2103330

Formula: - C9 H12 O -
Comments: Wójcik, Grażyna; Holband, Jolanta Variable-temperature studies of the 4-isopropylphenol crystal structure from X-ray diffraction. Comparison of thermal expansion and molecular dynamics with spectroscopic results Acta Crystallographica Section B 58(4) (2002) 684-689
Space group: P 41
Cell volume: 799.6
Cell parameters: 9.859; 9.865; 8.221; 90; 90; 90;

COD ID: 2103331

Formula: - C9 H12 O -
Comments: Wójcik, Grażyna; Holband, Jolanta Variable-temperature studies of the 4-isopropylphenol crystal structure from X-ray diffraction. Comparison of thermal expansion and molecular dynamics with spectroscopic results Acta Crystallographica Section B 58(4) (2002) 684-689
Space group: P 41
Cell volume: 820.16
Cell parameters: 9.928; 9.934; 8.316; 90; 90; 90;

COD ID: 2103332

Formula: - C8 H2 Cl4 K2 O8 -
Comments: Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I. Asymmetric hydrogen bonds in centrosymmetric environment. II. Neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate at 90K and 170K Acta Crystallographica Section B 58(4) (2002) 627-631
Space group: P 1
Cell volume: 344.6
Cell parameters: 5.048; 7.84; 8.839; 81.46; 85.05; 89.35;

COD ID: 2103333

Formula: - C8 H2 Cl4 K2 O8 -
Comments: Olovsson, I.; Ptasiewicz-Bak, H.; Gustafsson, T.; Majerz, I. Asymmetric hydrogen bonds in centrosymmetric environment. II. Neutron study of very short hydrogen bonds in potassium hydrogen dichloromaleate at 90K and 170K Acta Crystallographica Section B 58(4) (2002) 627-631
Space group: P 1
Cell volume: 342.6
Cell parameters: 5.031; 7.827; 8.835; 81.24; 85.17; 89.16;

COD ID: 2103334