LMucko/crystallography-open-database huggingface dataset:
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008560
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            B
_chemical_name_common            Boron
_chemical_name_mineral           Boron
_space_group_IT_number           134
_symmetry_space_group_name_Hall  'P 4n 2 -1n'
_symmetry_space_group_name_H-M   'P 42/n n m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.74
_cell_length_b                   8.74
_cell_length_c                   5.03
_cell_formula_units_Z            50
_cell_volume                     384.230
_database_code_amcsd             0011238
_exptl_crystal_density_diffrn    2.336
_cod_original_sg_symbol_H-M      'P 42/n n m'
_cod_database_code               9008560
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008561
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            B
_chemical_name_common            Boron
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.908
_cell_length_b                   4.908
_cell_length_c                   12.567
_cell_formula_units_Z            36
_cell_volume                     262.163
_exptl_crystal_density_diffrn    2.465
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_database_code               9008561
_database_code_amcsd 0011239
_cod_duplicate_entry 9011036
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008562
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Ga
_chemical_name_common            Gallium
_space_group_IT_number           64
_space_group_name_Hall           '-B 2ab 2'
_space_group_name_H-M_alt        'B m e b'
_symmetry_space_group_name_Hall  '-B 2ab 2'
_symmetry_space_group_name_H-M   'B m e b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   4.5107
_cell_length_b                   4.5167
_cell_length_c                   7.6448
_cell_formula_units_Z            8
_cell_volume                     155.751
_exptl_crystal_density_diffrn    5.947
_cod_original_sg_symbol_H-M      'B m a b'
_cod_database_code               9008562
_database_code_amcsd 0011240
Second edition. Interscience Publishers, New York, New York Sample supercooled to T = -16.3 C
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008563
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
 Sample supercooled to T = -16.3 C
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Ga
_chemical_name_common            Gallium
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   2.90
_cell_length_b                   8.13
_cell_length_c                   3.17
_cell_formula_units_Z            4
_cell_volume                     74.739
_diffrn_ambient_temperature      256.85
_exptl_crystal_density_diffrn    6.196
_cod_database_code               9008563
_database_code_amcsd 0011241
_cod_duplicate_entry 9012485
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008564
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            C
_chemical_name_common            Diamond
_chemical_name_mineral           Diamond
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.56679
_cell_length_b                   3.56679
_cell_length_c                   3.56679
_cell_formula_units_Z            8
_cell_volume                     45.377
_database_code_amcsd             0011242
_exptl_crystal_density_diffrn    3.516
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9008564
Second edition. Interscience Publishers, New York, New York Sample at T = 300 K
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008565
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
 Sample at T = 300 K
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Si
_chemical_name_common            Silicon
_chemical_name_mineral           Silicon
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.43070
_cell_length_b                   5.43070
_cell_length_c                   5.43070
_cell_formula_units_Z            8
_cell_volume                     160.165
_database_code_amcsd             0011243
_diffrn_ambient_temperature      300
_exptl_crystal_density_diffrn    2.329
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9008565
Second edition. Interscience Publishers, New York, New York Sample at T = 1573 K
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008566
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
 Sample at T = 1573 K
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Si
_chemical_name_common            Silicon
_chemical_name_mineral           Silicon
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.43070
_cell_length_b                   5.43070
_cell_length_c                   5.43070
_cell_formula_units_Z            8
_cell_volume                     160.165
_database_code_amcsd             0011244
_diffrn_ambient_temperature      1573
_exptl_crystal_density_diffrn    2.329
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9008566
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008567
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Ge
_chemical_name_common            Germanium
_chemical_name_mineral           Germanium
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.65735
_cell_length_b                   5.65735
_cell_length_c                   5.65735
_cell_formula_units_Z            8
_cell_volume                     181.067
_database_code_amcsd             0011245
_exptl_crystal_density_diffrn    5.327
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9008567
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008568
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Sn
_chemical_name_mineral           Tin-alpha
_space_group_IT_number           227
_symmetry_space_group_name_Hall  'F 4d 2 3 -1d'
_symmetry_space_group_name_H-M   'F d -3 m :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   6.4912
_cell_length_b                   6.4912
_cell_length_c                   6.4912
_cell_volume                     273.511
_database_code_amcsd             0011246
_exptl_crystal_density_diffrn    5.766
_cod_depositor_comments
;
 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_sg_symbol_H-M      'F d 3 m'
_cod_database_code               9008568
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008569
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            C
_chemical_name_common            Graphite
_chemical_name_mineral           Graphite
_space_group_IT_number           186
_symmetry_space_group_name_Hall  'P 6c -2c'
_symmetry_space_group_name_H-M   'P 63 m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   2.456
_cell_length_b                   2.456
_cell_length_c                   6.696
_cell_formula_units_Z            4
_cell_volume                     34.979
_database_code_amcsd             0011247
_exptl_crystal_density_diffrn    2.281
_cod_database_code               9008569
Second edition. Interscience Publishers, New York, New York Sample known as white tin
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008570
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
 Sample known as white tin
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Sn
_chemical_name_mineral           Tin
_space_group_IT_number           141
_symmetry_space_group_name_Hall  'I 4bw 2bw -1bw'
_symmetry_space_group_name_H-M   'I 41/a m d :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.8197
_cell_length_b                   5.8197
_cell_length_c                   3.17488
_cell_volume                     107.530
_database_code_amcsd             0011248
_exptl_crystal_density_diffrn    7.333
_cod_depositor_comments
;
 Added the _cell_formula_units_Z data item.

 Antanas Vaitkus,
 2021-04-22
;
_cod_original_sg_symbol_H-M      'I 41/a m d'
_cod_database_code               9008570
Second edition. Interscience Publishers, New York, New York Sample at T = 4.2 K
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008571
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
 Sample at T = 4.2 K
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            N2
_chemical_name_common            Nitrogen
_chemical_name_mineral           Nitrogen
_space_group_IT_number           205
_symmetry_space_group_name_Hall  '-P 2ac 2ab 3'
_symmetry_space_group_name_H-M   'P a -3'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   5.644
_cell_length_b                   5.644
_cell_length_c                   5.644
_cell_formula_units_Z            4
_cell_volume                     179.788
_database_code_amcsd             0011249
_diffrn_ambient_temperature      4.2
_exptl_crystal_density_diffrn    1.035
_cod_original_sg_symbol_H-M      'P a 3'
_cod_database_code               9008571
Second edition. Interscience Publishers, New York, New York Sample known as black phosphorus
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008572
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
 Sample known as black phosphorus
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            P
_chemical_name_common            Phosphorus
_space_group_IT_number           64
_space_group_name_Hall           '-B 2ab 2'
_space_group_name_H-M_alt        'B m e b'
_symmetry_space_group_name_Hall  '-B 2ab 2'
_symmetry_space_group_name_H-M   'B m e b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.31
_cell_length_b                   4.38
_cell_length_c                   10.50
_cell_formula_units_Z            8
_cell_volume                     152.227
_exptl_crystal_density_diffrn    2.703
_cod_original_sg_symbol_H-M      'B m a b'
_cod_database_code               9008572
_database_code_amcsd 0011250
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 239–444; doi:

data_9008573
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              239
_journal_page_last               444
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            As
_chemical_name_common            Arsenolamprite
_chemical_name_mineral           Arsenolamprite
_space_group_IT_number           64
_space_group_name_Hall           '-B 2ab 2'
_space_group_name_H-M_alt        'B m e b'
_symmetry_space_group_name_Hall  '-B 2ab 2'
_symmetry_space_group_name_H-M   'B m e b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   3.63
_cell_length_b                   4.45
_cell_length_c                   10.96
_cell_formula_units_Z            8
_cell_volume                     177.042
_exptl_crystal_density_diffrn    5.622
_cod_original_sg_symbol_H-M      'B m a b'
_cod_database_code               9008573
_database_code_amcsd 0011251
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008574
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            As
_chemical_name_common            Arsenic
_chemical_name_mineral           Arsenolamprite
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                54.167
_cell_angle_beta                 54.167
_cell_angle_gamma                54.167
_cell_length_a                   4.131
_cell_length_b                   4.131
_cell_length_c                   4.131
_cell_formula_units_Z            2
_cell_volume                     43.061
_database_code_amcsd             0011252
_exptl_crystal_density_diffrn    5.778
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_database_code               9008574
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008575
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Sb
_chemical_name_common            Antimony
_chemical_name_mineral           Antimony
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                57.108
_cell_angle_beta                 57.108
_cell_angle_gamma                57.108
_cell_length_a                   4.50661
_cell_length_b                   4.50661
_cell_length_c                   4.50661
_cell_formula_units_Z            2
_cell_volume                     60.406
_database_code_amcsd             0011253
_exptl_crystal_density_diffrn    6.694
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_database_code               9008575
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008576
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Bi
_chemical_name_common            Bismuth
_chemical_name_mineral           Bismuth
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-P 3* 2'
_symmetry_space_group_name_H-M   'R -3 m :R'
_cell_angle_alpha                57.237
_cell_angle_beta                 57.237
_cell_angle_gamma                57.237
_cell_length_a                   4.7459
_cell_length_b                   4.7459
_cell_length_c                   4.7459
_cell_formula_units_Z            2
_cell_volume                     70.776
_database_code_amcsd             0011254
_exptl_crystal_density_diffrn    9.806
_cod_original_sg_symbol_H-M      'R -3 m'
_cod_database_code               9008576
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008577
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            S8
_chemical_name_common            Sulphur
_chemical_name_mineral           Sulphur
_space_group_IT_number           70
_symmetry_space_group_name_Hall  '-F 2uv 2vw'
_symmetry_space_group_name_H-M   'F d d d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.467
_cell_length_b                   12.870
_cell_length_c                   24.493
_cell_formula_units_Z            16
_cell_volume                     3299.459
_database_code_amcsd             0011255
_exptl_crystal_density_diffrn    2.066
_cod_original_sg_symbol_H-M      'F d d d'
_cod_database_code               9008577
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008578
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            S6
_chemical_name_common            Sulphur
_chemical_name_mineral           Sulphur
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-R 3'
_symmetry_space_group_name_H-M   'R -3 :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   10.818
_cell_length_b                   10.818
_cell_length_c                   4.280
_cell_formula_units_Z            3
_cell_volume                     433.779
_exptl_crystal_density_diffrn    2.210
_cod_original_sg_symbol_H-M      'R -3'
_cod_database_code               9008578
_database_code_amcsd 0011256
_cod_duplicate_entry 9012311
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008579
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Se
_chemical_name_common            Selenium
_chemical_name_mineral           Selenium
_space_group_IT_number           154
_symmetry_space_group_name_Hall  'P 32 2"'
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   4.35517
_cell_length_b                   4.35517
_cell_length_c                   4.94945
_cell_formula_units_Z            3
_cell_volume                     81.301
_database_code_amcsd             0011257
_exptl_crystal_density_diffrn    4.838
_cod_database_code               9008579
Second edition. Interscience Publishers, New York, New York
Wyckoff, R. W. G.; Crystal Structures 1 (1963) 7–83; doi:

data_9008580
_publ_section_title
;
 Second edition. Interscience Publishers, New York, New York
;
_journal_name_full               'Crystal Structures'
_journal_page_first              7
_journal_page_last               83
_journal_volume                  1
_journal_year                    1963
_chemical_formula_sum            Te
_chemical_name_common            Tellurium
_chemical_name_mineral           Tellurium
_chemical_name_systematic        Tellurium
_space_group_IT_number           154
_space_group_name_Hall           'P 32 2"'
_space_group_name_H-M_alt        'P 32 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   4.44693
_cell_length_b                   4.44693
_cell_length_c                   5.91492
_cell_volume                     101.298
_exptl_crystal_density_diffrn    6.275
_cod_database_code               9008580