LMucko/crystallography-open-database huggingface dataset:
Crystal structure of 1,1'-binaphthyl-2,2'-di(pyrid-2-ylamine), C~30~H~22~N~4~
Kempe, Rhett; Hillebrand, Gerhard; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 279–280; doi:

data_8101251
_publ_section_title
;
Crystal structure of 1,1'-binaphthyl-2,2'-di(pyrid-2-ylamine), C~30~H~22~N~4~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              279
_journal_page_last               280
_journal_volume                  215
_journal_year                    2000
_chemical_formula_sum            'C30 H22 N4'
_chemical_formula_weight         438.52
_space_group_IT_number           20
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  'C 2c 2'
_symmetry_space_group_name_H-M   'C 2 2 21'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   11.705(2)
_cell_length_b                   13.185(3)
_cell_length_c                   29.061(6)
_cell_measurement_temperature    293(2)
_cell_volume                     4485.0(16)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.299
_refine_ls_R_factor_obs          0.0620
_refine_ls_wR_factor_obs         0.1350
_cod_database_code               8101251
Crystal structure of 1,1'-binaphthyl-2,2'-di(lepid-2font-ylamine)— methanol (1/1), (C~40~H~30~N~4~) · CH~3~OH
Kempe, Rhett; Hillebrand, Gerhard; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 281–282; doi:

data_8101252
_publ_section_title
;
Crystal structure of 1,1'-binaphthyl-2,2'-di(lepid-2font-ylamine)---
methanol (1/1), (C~40~H~30~N~4~) &#x00B7; CH~3~OH
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              281
_journal_page_last               282
_journal_volume                  215
_journal_year                    2000
_chemical_formula_structural     '(C40 H30 N4) . C H3 O H'
_chemical_formula_sum            'C41 H34 N4 O'
_chemical_formula_weight         598.72
_space_group_IT_number           4
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  'P 2yb'
_symmetry_space_group_name_H-M   'P 1 21 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 104.720(13)
_cell_angle_gamma                90.00
_cell_formula_units_Z            2
_cell_length_a                   7.6240(10)
_cell_length_b                   19.709(3)
_cell_length_c                   10.924(2)
_cell_measurement_temperature    293(2)
_cell_volume                     1587.6(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.252
_refine_ls_R_factor_obs          0.0716
_refine_ls_wR_factor_obs         0.1812
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2017-07-12
;
_cod_original_sg_symbol_H-M      'P 21'
_cod_database_code               8101252
Crystal structure of 3a<i>S</i>*,4<i>S</i>*,7a<i>R</i>*-4-ethoxy-3a, 7a-dihydro-3,7-diphenyl-4<i>H</i>-1,5-dioxa-2,6-diaza-indene, C~19~H~18~N~2~O~3~
Schmidt, E.; Reißig, H.-U.; Rademacher, O.; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 283–284; doi:

data_8101253
_publ_section_title
;
Crystal structure of 3a<i>S</i>*,4<i>S</i>*,7a<i>R</i>*-4-ethoxy-3a,
7a-dihydro-3,7-diphenyl-4<i>H</i>-1,5-dioxa-2,6-diaza-indene, 
C~19~H~18~N~2~O~3~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              283
_journal_page_last               284
_journal_volume                  215
_journal_year                    2000
_chemical_formula_moiety         'C19 H18 N2 O3'
_chemical_formula_sum            'C19 H18 N2 O3'
_chemical_formula_weight         322.35
_chemical_melting_point          419.5(5)
_chemical_name_common
;3aS^*^.4S^*^7aR^*^-4-Ethoxy-3a,7a-dihydro-3,7-diphenyl-4H-1,5-dioxa-2,6-diaza-
indene
;
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   15.957(3)
_cell_length_b                   7.958(2)
_cell_length_c                   26.041(5)
_cell_measurement_temperature    293(2)
_cell_volume                     3307.0(12)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.295
_cod_depositor_comments
;
The following automatic conversions were performed:

'_chemical_melting_point' value '419 - 420' was changed to '419.5(5)'
- the average value was taken and precision was
estimated.

'_symmetry_cell_setting' tag value 'orthorombic' was
replaced with 'orthorhombic' value.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 
;
_cod_database_code               8101253
Crystal structure of 2-trichloromethyl-4-phenyl-3<i>H</i>-1,5-benzodiazepine, C~16~H~11~Cl~3~N~2~
Schulz Lang, Ernesto; Gauze Bonacorso, Helio; Bittencourt, Sandra R. T.; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 242–244; doi:

data_8101254
_publ_section_title
;
Crystal structure of 2-trichloromethyl-4-phenyl-3<i>H</i>-1,5-benzodiazepine, 
C~16~H~11~Cl~3~N~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              242
_journal_page_last               244
_journal_volume                  215
_journal_year                    2000
_chemical_formula_moiety         C16H11Cl3N2
_chemical_formula_sum            'C16 H11 Cl3 N2'
_chemical_formula_weight         337.62
_chemical_name_common            1,5-benzodiazepine
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.24(3)
_cell_angle_gamma                90.00
_cell_formula_units_Z            12
_cell_length_a                   16.631(4)
_cell_length_b                   16.322(3)
_cell_length_c                   17.405(6)
_cell_measurement_temperature    293(2)
_cell_volume                     4617(2)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    1.457
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               8101254
Crystal structure of bis[potassium 18-crown-6-1,2-bis(dimethylfluorostannyl) benzene fluoride] pentahydrate, 2{[K·18-Crown-6]^+^[O-C~6~H~4~(SnMe~2~F) ~2~·F]^‒^} · 5H~2~O
Altmann, Reiner; Jurkschat, Klaus; Schürmann, Markus; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 309–311; doi:

data_8101255
_publ_section_title
;
Crystal structure of bis[potassium 18-crown-6-1,2-bis(dimethylfluorostannyl) 
benzene fluoride] pentahydrate, 2{[K&#x00B7;18-Crown-6]^+^[O-C~6~H~4~(SnMe~2~F)
~2~&#x00B7;F]^--^} &#x00B7; 5H~2~O
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              309
_journal_page_last               311
_journal_volume                  215
_journal_year                    2000
_chemical_formula_structural
;
 2{[K&#x00B7;18-crown-6]^+^ 
[o-C~6~H~4~(SnMe~2~F)~2~&#x00B7;F]}^-^&#x00B7;5H~2~O
;
_chemical_formula_sum            'C44 H90 F6 K2 O17 Sn4'
_chemical_formula_weight         1558.12
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   17.007(1)
_cell_length_b                   21.319(1)
_cell_length_c                   18.343(1)
_cell_measurement_temperature    291(1)
_cell_volume                     6650.7(6)
_diffrn_ambient_temperature      291(1)
_exptl_crystal_density_diffrn    1.556
_cod_depositor_comments
;
The following automatic conversions were performed:
'_geom_bond_publ_flag' value 'Y' changed to 'y' according to
'/home/saulius/struct/CIF-dictionaries/cif_core.dic' dictionary named
'cif_core.dic' version 2.4.1 from 2010-06-29 (25 times).

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_sg_symbol_H-M      'P 21 21 21'
_cod_database_code               8101255
Crystal structure of <i>tert</i>-butyl 2-(2-benzoyl-3-phenylcyclopropyl) acetate, C~22~H~24~O~3~
Avery, T. D.; Fallon, G. D.; Taylor, D. K.; Tiekink, E. R. T.; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 257–258; doi:

data_8101256
_publ_section_title
;
Crystal structure of <i>tert</i>-butyl 2-(2-benzoyl-3-phenylcyclopropyl)
acetate, C~22~H~24~O~3~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              257
_journal_page_last               258
_journal_volume                  215
_journal_year                    2000
_chemical_formula_moiety         'C22 H24 O3'
_chemical_formula_sum            'C22 H24 O3'
_chemical_formula_weight         336.43
_space_group_IT_number           19
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      19
_symmetry_space_group_name_Hall  'P 2ac 2ab'
_symmetry_space_group_name_H-M   'P 21 21 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.8623(4)
_cell_length_b                   8.5835(4)
_cell_length_c                   35.864(2)
_cell_measurement_temperature    173
_cell_volume                     1804.6(2)
_diffrn_ambient_temperature      173
_exptl_crystal_density_diffrn    1.238
_cod_database_code               8101256
Crystal structure of 1-(phthalimidomethyl)-1,2-dicarba-<i>closo</i>- dodecaborane, C~11~H~17~B~10~NO~2~
Rendina, L. M.; Todd, J. A.; Tiekink, E. R. T.; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 259–260; doi:

data_8101257
_publ_section_title
;
Crystal structure of 1-(phthalimidomethyl)-1,2-dicarba-<i>closo</i>-
dodecaborane, C~11~H~17~B~10~NO~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              259
_journal_page_last               260
_journal_volume                  215
_journal_year                    2000
_chemical_formula_moiety         'C11 H17 B10 N O2 '
_chemical_formula_sum            'C11 H17 B10 N O2'
_chemical_formula_weight         303.36
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 98.680(9)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.686(1)
_cell_length_b                   22.427(7)
_cell_length_c                   9.624(3)
_cell_measurement_temperature    173
_cell_volume                     1639.9(6)
_diffrn_ambient_temperature      173
_exptl_crystal_density_diffrn    1.229
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'C11 H17 B10 N O2 '
_cod_database_code               8101257
Crystal structure of the defect clathrate Cs~8~Sn~44◊2~
von Schnering, Hans Georg; Kroener, Rudolf; Baitinger, Michael; Peters, Karl; Nesper, Reinhard; Grin, Yuri; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 205–206; doi:

data_8101258
_publ_section_title
;
Crystal structure of the defect clathrate Cs~8~Sn~44&#x25CA;2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              205
_journal_page_last               206
_journal_volume                  215
_journal_year                    2000
_chemical_formula_sum            'Cs8 Sn44'
_chemical_formula_weight         6285.60
_space_group_IT_number           223
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-P 4n 2 3'
_symmetry_space_group_name_H-M   'P m -3 n'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   12.1050(10)
_cell_length_b                   12.1050(10)
_cell_length_c                   12.1050(10)
_cell_measurement_temperature    293(2)
_cell_volume                     1773.8(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    6.107
_cod_database_code               8101258
Crystal structure of the defect clathrate Cs~8~Sn~44◊2~
von Schnering, Hans Georg; Kroener, Rudolf; Baitinger, Michael; Peters, Karl; Nesper, Reinhard; Grin, Yuri; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 205–206; doi:

data_8101259
_publ_section_title
;
Crystal structure of the defect clathrate Cs~8~Sn~44&#x25CA;2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              205
_journal_page_last               206
_journal_volume                  215
_journal_year                    2000
_chemical_formula_sum            'Cs8 Sn44'
_chemical_formula_weight         6285.60
_space_group_IT_number           223
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-P 4n 2 3'
_symmetry_space_group_name_H-M   'P m -3 n'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            1
_cell_length_a                   12.1050(10)
_cell_length_b                   12.1050(10)
_cell_length_c                   12.1050(10)
_cell_measurement_temperature    293(2)
_cell_volume                     1773.8(3)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    6.107
_cod_database_code               8101259
Crystal structure of cobalt chromium germanium, CoCrGe
Wirringa, Jörg; Wartchow, Rudolf; Binnewies, Michael; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 197–198; doi:

data_8101260
_publ_section_title
;
Crystal structure of cobalt chromium germanium, CoCrGe
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              197
_journal_page_last               198
_journal_volume                  215
_journal_year                    2000
_chemical_formula_sum            'Co Cr Ge'
_chemical_formula_weight         183.52
_space_group_IT_number           194
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            2
_cell_length_a                   4.0920(10)
_cell_length_b                   4.0920(10)
_cell_length_c                   5.145(2)
_cell_measurement_temperature    300(2)
_cell_volume                     74.61(4)
_diffrn_ambient_temperature      300(2)
_exptl_crystal_density_diffrn    8.169
_cod_database_code               8101260
Crystal structure of ytterbium-dialuminium-digermanium, YbAl~2~Ge~2~
Zhao, Jing-Tai; Paschen, Silke; Schnelle, Walter; Grin, Yuri; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 200–200; doi:

data_8101261
_publ_section_title
;
Crystal structure of ytterbium-dialuminium-digermanium, YbAl~2~Ge~2~
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              200
_journal_page_last               200
_journal_volume                  215
_journal_year                    2000
_chemical_formula_structural     'Yb Al2 Ga2'
_chemical_formula_sum            'Al2 Ge2 Yb'
_chemical_formula_weight         372.18
_chemical_name_common            YbAl2Ge2
_space_group_IT_number           164
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            1
_cell_length_a                   4.1789(6)
_cell_length_b                   4.1789(6)
_cell_length_c                   7.055(2)
_cell_measurement_temperature    293(2)
_cell_volume                     106.70(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    5.792
_cod_database_code               8101261
Crystal structure of dichromium monoborotriphosphate, Cr~2~[BP~3~O~12~]
Mi, Jin-Xiao; Zhao, Jing-Tai; Mao, Shao-Yu; Huang, Ya-Xi; Engelhardt, Holger; Kniep, Rüdiger; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 201–202; doi:10.1515/ncrs-2000-0205

data_8101262
_publ_section_title
;
 Crystal structure of dichromium monoborotriphosphate, Cr~2~[BP~3~O~12~]
;
_journal_coden_ASTM              ZKNSFT
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              201
_journal_page_last               202
_journal_paper_doi               10.1515/ncrs-2000-0205
_journal_volume                  215
_journal_year                    2000
_chemical_formula_moiety         Cr2BP3O12
_chemical_formula_structural     'Cr2 B P3 O12'
_chemical_formula_sum            'B2 Cr4 O24 P6'
_chemical_formula_weight         799.44
_chemical_name_common            Cr2BP3O12
_space_group_IT_number           143
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_Hall  'P 3'
_symmetry_space_group_name_H-M   'P 3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   7.95419(6)
_cell_length_b                   7.95419(6)
_cell_length_c                   7.36130(1)
_cell_measurement_temperature    295(2)
_cell_volume                     403.345(1)
_diffrn_ambient_environment      air
_diffrn_ambient_temperature      295(2)
_exptl_crystal_density_diffrn    3.2910(1)
_pd_proc_ls_prof_R_factor        0.1232
_pd_proc_ls_prof_wR_expected     0.0703
_pd_proc_ls_prof_wR_factor       0.1146
_refine_ls_R_I_factor            0.0488
_cod_original_formula_sum        'Cr4 P6 B2 O24'
_cod_database_code               8101262
Crystal structure of rubidium vanadium(III) catena-[monohydrogenmonoborate- bis(monophosphate)], RbV[BP~2~O~8~(OH)]
Engelhardt, Holger; Borrmann, Horst; Kniep, Rüdiger; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 203–206; doi:

data_8101263
_publ_section_title
;
Crystal structure of rubidium vanadium(III) catena-[monohydrogenmonoborate-
bis(monophosphate)], RbV[BP~2~O~8~(OH)]
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              203
_journal_page_last               206
_journal_volume                  215
_journal_year                    2000
_chemical_formula_structural     'Rb V [B P2 O8 (O H)]'
_chemical_formula_sum            'B H O9 P2 Rb V'
_chemical_formula_weight         354.17
_space_group_IT_number           14
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 102.0781(8)
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   9.3789(5)
_cell_length_b                   8.3296(4)
_cell_length_c                   9.6701(3)
_cell_measurement_temperature    293(2)
_cell_volume                     738.73(6)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    3.184
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_original_formula_sum        'H B O9 P2 Rb V'
_cod_database_code               8101263
Crystal structure of tetraterbium hexabromide monoboride, Tb~4~Br~6~B
Mattausch, Hansjuergen; Oeckler, Oliver; Simon, Arndt; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 199–199; doi:

data_8101264
_publ_section_title
;
Crystal structure of tetraterbium hexabromide monoboride, Tb~4~Br~6~B
;
_journal_issue                   2
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              199
_journal_page_last               199
_journal_volume                  215
_journal_year                    2000
_chemical_formula_structural     'Tb4 Br6 B'
_chemical_formula_sum            'B Br6 Tb4'
_chemical_formula_weight         1125.95
_chemical_name_common            'tetrayttrium hexabromide monoboride'
_space_group_IT_number           15
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 97.92(1)
_cell_angle_gamma                90.00
_cell_formula_units_Z            8
_cell_length_a                   17.825(2)
_cell_length_b                   11.1644(9)
_cell_length_c                   12.541(1)
_cell_measurement_temperature    293(2)
_cell_volume                     2472.0(4)
_diffrn_ambient_temperature      293(2)
_exptl_crystal_density_diffrn    6.051
_cod_original_sg_symbol_H-M      'C 2/c'
_cod_database_code               8101264
Crystal structure of diphenylguanidinium dihydrogenphosphite–phosphoric acid–water (2/1/1), 2[(C~13~N~3~H~14~)(H~2~PO~3~)] · H~3~PO~3~ · H~2~O
Galitsky, N.; Cody, V.; Wallet, J.-C.; Zeitschrift für Kristallographie - New Crystal Structures 215 (2000) 352–356; doi:

data_8101265
_publ_section_title
;
Crystal structure of diphenylguanidinium dihydrogenphosphite--phosphoric 
acid--water (2/1/1), 2[(C~13~N~3~H~14~)(H~2~PO~3~)] &#x00B7; H~3~PO~3~ 
&#x00B7; H~2~O
;
_journal_issue                   3
_journal_name_full
'Zeitschrift f\"ur Kristallographie - New Crystal Structures'
_journal_page_first              352
_journal_page_last               356
_journal_volume                  215
_journal_year                    2000
_chemical_formula_moiety         'C15 H13 N3 O5'
_chemical_formula_sum            'C15 H13 N3 O5'
_chemical_formula_weight         315.28
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                105.566(9)
_cell_angle_beta                 105.287(8)
_cell_angle_gamma                93.15(1)
_cell_formula_units_Z            2
_cell_length_a                   6.979(1)
_cell_length_b                   8.309(1)
_cell_length_c                   13.128(1)
_cell_measurement_temperature    292.2
_cell_volume                     701.0(2)
_diffrn_ambient_temperature      292.2
_exptl_crystal_density_diffrn    1.494
_cod_database_code               8101265