LMucko/crystallography-open-database huggingface dataset:
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103372
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C10 H7 N2 O10 Cu Cr2'
_chemical_formula_sum            'C10 H7 Cr2 Cu N2 O10'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   8.986
_cell_length_b                   8.986
_cell_length_c                   19.040
_cell_volume                     1331.467
_cod_data_source_file            bk0117.cif
_cod_data_source_block           SOTROI
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C10 H7 N2 O10 Cu Cr2'
_cod_database_code               2103372
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103373
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C20 H22 N4 O2'
_chemical_formula_sum            'C20 H22 N4 O2'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 31 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   9.280
_cell_length_b                   9.280
_cell_length_c                   19.329
_cell_volume                     1441.571
_cod_data_source_file            bk0117.cif
_cod_data_source_block           TAXZOH
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103373
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103374
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C216 H180 Se50 Hg32'
_chemical_formula_sum            'C216 H180 Hg32 Se50'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   22.753
_cell_length_b                   22.753
_cell_length_c                   53.02
_cell_volume                     23771.013
_cod_data_source_file            bk0117.cif
_cod_data_source_block           TUJFUZ
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C216 H180 Se50 Hg32'
_cod_database_code               2103374
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103375
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C22 H28 O2 P2 I V'
_chemical_formula_sum            'C22 H28 I O2 P2 V'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            9
_cell_length_a                   14.305
_cell_length_b                   14.305
_cell_length_c                   32.852
_cell_volume                     5821.946
_cod_data_source_file            bk0117.cif
_cod_data_source_block           WEKKEC
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C22 H28 O2 P2 I V'
_cod_database_code               2103375
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103376
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C56 H40 N4 O8 Zn2, H2 O'
_chemical_formula_sum            'C56 H42 N4 O9 Zn2'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   9.865
_cell_length_b                   9.865
_cell_length_c                   44.179
_cell_volume                     3723.409
_cod_data_source_file            bk0117.cif
_cod_data_source_block           WIXJIW
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103376
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103377
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C36 H42 N2 O6 Fe2 Pd2, C H2 Cl'
_chemical_formula_sum            'C37 H44 Cl Fe2 N2 O6 Pd2'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   11.026
_cell_length_b                   11.026
_cell_length_c                   27.253
_cell_volume                     2869.333
_cod_data_source_file            bk0117.cif
_cod_data_source_block           XAXJOV
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C37 H44 N2 O6 Cl Fe2 Pd2'
_cod_database_code               2103377
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103378
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C48 H94 N8 O31 Mn3 Br3, 8(H2 O)'
_chemical_formula_sum            'C48 H110 Br3 Mn3 N8 O39'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 31 1 2'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   12.857
_cell_length_b                   12.857
_cell_length_c                   40.961
_cell_volume                     5863.818
_cod_data_source_file            bk0117.cif
_cod_data_source_block           XEJYOA
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C48 H110 N8 O39 Mn3 Br3'
_cod_database_code               2103378
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103379
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C18 H16 N2 O5 Cl2'
_chemical_formula_sum            'C18 H16 Cl2 N2 O5'
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 64'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   15.055
_cell_length_b                   15.066
_cell_length_c                   6.886
_cell_volume                     1352.622
_cod_data_source_file            bk0117.cif
_cod_data_source_block           XEVTEX
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C18 H16 N2 O5 Cl2'
_cod_database_code               2103379
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103380
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C10 H14 N2 O8 Co, H4 O1.5'
_chemical_formula_sum            'C10 H20 Co N2 O9.5'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 31 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   11.053
_cell_length_b                   11.053
_cell_length_c                   9.889
_cell_volume                     1046.269
_cod_data_source_file            bk0117.cif
_cod_data_source_block           YASROZ
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_formula_sum        'C10 H20 N2 O9.5 Co'
_cod_database_code               2103380
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103381
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C29 H44 O9, 0.5(C3 H6 O)'
_chemical_formula_sum            'C30.5 H47 O9.5'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   12.115
_cell_length_b                   12.115
_cell_length_c                   36.851
_cell_volume                     4684.106
_cod_data_source_file            bk0117.cif
_cod_data_source_block           YONLIW
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103381
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103382
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C32 H42 N2 P2 Si2'
_chemical_formula_sum            'C32 H42 N2 P2 Si2'
_symmetry_cell_setting           hexagonal
_symmetry_space_group_name_H-M   'P 64'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   15.914
_cell_length_b                   15.914
_cell_length_c                   11.658
_cell_volume                     2556.898
_cod_data_source_file            bk0117.cif
_cod_data_source_block           ZARSEQ
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103382
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103383
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C24 H38 N2 O2 Os'
_chemical_formula_sum            'C24 H38 N2 O2 Os'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 31 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   8.539
_cell_length_b                   8.539
_cell_length_c                   28.123
_cell_volume                     1775.850
_cod_data_source_file            bk0117.cif
_cod_data_source_block           ZEVYOO
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103383
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103384
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C50 H46 N5 O21 P4 Pr'
_chemical_formula_sum            'C50 H46 N5 O21 P4 Pr'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 32 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            6
_cell_length_a                   15.710
_cell_length_b                   15.710
_cell_length_c                   40.067
_cell_volume                     8563.865
_cod_data_source_file            bk0117.cif
_cod_data_source_block           ZIFYOC
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103384
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103385
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C18 H18 N2 O2'
_chemical_formula_sum            'C18 H18 N2 O2'
_symmetry_cell_setting           trigonal
_symmetry_space_group_name_H-M   'P 31 2 1'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                120.00
_cell_formula_units_Z            3
_cell_length_a                   12.846
_cell_length_b                   12.846
_cell_length_c                   8.138
_cell_volume                     1163.012
_cod_data_source_file            bk0117.cif
_cod_data_source_block           ZUKKOF
_cod_depositor_comments
;
 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_database_code               2103385
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103386
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C34 H32 N2 Nb2 O2, B F4, C H3 O2'
_chemical_formula_sum            'C35 H35 B F4 N3 Nb2 O4'
_space_group_crystal_system      trigonal
_space_group_IT_number           155
_space_group_name_Hall           'P 3* 2'
_space_group_name_H-M_alt        'R 3 2 :R'
_cell_angle_alpha                74.98
_cell_angle_beta                 74.98
_cell_angle_gamma                74.98
_cell_formula_units_Z            3
_cell_length_a                   17.618
_cell_length_b                   17.618
_cell_length_c                   17.618
_cell_volume                     4992.028
_cod_data_source_file            bk0117.cif
_cod_data_source_block           BENRAN
_cod_depositor_comments
;
 Updating space group information and adding the symmetry operation list
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03

 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_sg_symbol_H-M      'R 32'
_cod_original_formula_sum        'C35 H35 N3 O4 B F4 Nb2'
_cod_database_code               2103386
The space groups of point group <i>C</i>~3~: some corrections, some comments
Marsh, Richard E.; Acta Crystallographica Section B 58 (2002) 893–899; doi:10.1107/S0108768102011758

data_2103387
_publ_section_title
;
 The space groups of point group <i>C</i>~3~: some corrections, some
 comments
;
_journal_issue                   5
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              893
_journal_page_last               899
_journal_paper_doi               10.1107/S0108768102011758
_journal_volume                  58
_journal_year                    2002
_chemical_formula_moiety         'C8 H20 O4 S2 Si2'
_chemical_formula_sum            'C8 H20 O4 S2 Si2'
_space_group_crystal_system      trigonal
_space_group_IT_number           148
_space_group_name_Hall           '-R 3'
_space_group_name_H-M_alt        'R -3 :H'
_cell_angle_alpha                90.0
_cell_angle_beta                 90.0
_cell_angle_gamma                120.0
_cell_formula_units_Z            9
_cell_length_a                   12.722
_cell_length_b                   12.722
_cell_length_c                   26.127
_cell_volume                     3662.106
_cod_data_source_file            bk0117.cif
_cod_data_source_block           BIVLUN
_cod_depositor_comments
;
 Updating space group information.

 Antanas Vaitkus,
 2018-06-14

 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2018-02-09

 Adding the _cell_formula_units_Z and _chemical_formula_moiety data items
 after consulting the original publication.

 Antanas Vaitkus,
 2017-08-03
;
_cod_original_sg_symbol_H-M      'R -3'
_cod_database_code               2103387