LMucko/crystallography-open-database huggingface dataset:
Structures of nine histamine H~2~ antagonists related to <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
Prout, K.; Burns, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Sach, G. S.; Acta Crystallographica Section B 49 (1993) 547–559; doi:10.1107/S0108768193000217

data_2100958
_publ_section_title
;
 Structures of nine histamine H~2~ antagonists related to
 <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              547
_journal_page_last               559
_journal_paper_doi               10.1107/S0108768193000217
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C12 H17 N5,H2 O1'
_chemical_formula_sum            'C12 H19 N5 O'
_chemical_formula_weight         249.31
_symmetry_cell_setting           monoclinic
_symmetry_space_group_name_H-M   'I 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 99.38(2)
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   15.570(8)
_cell_length_b                   10.390(3)
_cell_length_c                   17.383(4)
_cell_volume                     2774.5(18)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.54018
_exptl_absorpt_coefficient_mu    0.662
_exptl_crystal_density_diffrn    1.19
_exptl_crystal_F_000             1072
_cod_data_source_file            ha0114.cif
_cod_data_source_block           ha0114d
_cod_original_cell_volume        2774.3
_cod_original_formula_sum        'C12 H19 N5 O1'
_cod_database_code               2100958
Structures of nine histamine H~2~ antagonists related to <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
Prout, K.; Burns, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Sach, G. S.; Acta Crystallographica Section B 49 (1993) 547–559; doi:10.1107/S0108768193000217

data_2100959
_publ_section_title
;
 Structures of nine histamine H~2~ antagonists related to
 <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              547
_journal_page_last               559
_journal_paper_doi               10.1107/S0108768193000217
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C13 H19 N5,H2 O1'
_chemical_formula_sum            'C13 H21 N5 O'
_chemical_formula_weight         263.34
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                92.960(10)
_cell_angle_beta                 95.890(10)
_cell_angle_gamma                91.490(10)
_cell_formula_units_Z            2
_cell_length_a                   7.860(2)
_cell_length_b                   9.3880(10)
_cell_length_c                   9.7060(10)
_cell_volume                     711.1(2)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.54018
_exptl_absorpt_coefficient_mu    0.672
_exptl_crystal_density_diffrn    1.23
_exptl_crystal_F_000             284
_cod_data_source_file            ha0114.cif
_cod_data_source_block           ha0114e
_cod_original_cell_volume        711.11
_cod_original_formula_sum        'C13 H21 N5 O1'
_cod_database_code               2100959
Structures of nine histamine H~2~ antagonists related to <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
Prout, K.; Burns, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Sach, G. S.; Acta Crystallographica Section B 49 (1993) 547–559; doi:10.1107/S0108768193000217

data_2100960
_publ_section_title
;
 Structures of nine histamine H~2~ antagonists related to
 <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              547
_journal_page_last               559
_journal_paper_doi               10.1107/S0108768193000217
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C13 H19 N5 O1'
_chemical_formula_sum            'C13 H19 N5 O'
_chemical_formula_weight         261.33
_space_group_crystal_system      monoclinic
_space_group_IT_number           15
_space_group_name_Hall           '-I 2yc'
_space_group_name_H-M_alt        'I 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 111.470(10)
_cell_angle_gamma                90
_cell_formula_units_Z            16
_cell_length_a                   23.780(4)
_cell_length_b                   9.162(2)
_cell_length_c                   28.144(5)
_cell_volume                     5706.3(19)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.088
_exptl_crystal_density_diffrn    1.22
_exptl_crystal_F_000             2240
_cod_data_source_file            ha0114.cif
_cod_data_source_block           ha0114f
_cod_depositor_comments
;
 Updating space group information.

 Antanas Vaitkus,
 2018-05-07
;
_cod_original_cell_volume        5706.8
_cod_original_formula_sum        'C13 H19 N5 O1'
_cod_database_code               2100960
Structures of nine histamine H~2~ antagonists related to <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
Prout, K.; Burns, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Sach, G. S.; Acta Crystallographica Section B 49 (1993) 547–559; doi:10.1107/S0108768193000217

data_2100961
_publ_section_title
;
 Structures of nine histamine H~2~ antagonists related to
 <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              547
_journal_page_last               559
_journal_paper_doi               10.1107/S0108768193000217
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C12 H16 F1 N5'
_chemical_formula_sum            'C12 H16 F N5'
_chemical_formula_weight         249.29
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_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
_cell_angle_beta                 93.140(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.6267(3)
_cell_length_b                   13.8460(10)
_cell_length_c                   19.828(2)
_cell_volume                     1268.30(18)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.54018
_exptl_absorpt_coefficient_mu    0.789
_exptl_crystal_density_diffrn    1.31
_exptl_crystal_F_000             528
_cod_data_source_file            ha0114.cif
_cod_data_source_block           ha0114g
_cod_original_cell_volume        1268.95
_cod_original_formula_sum        'C12 H16 F1 N5'
_cod_database_code               2100961
Structures of nine histamine H~2~ antagonists related to <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
Prout, K.; Burns, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Sach, G. S.; Acta Crystallographica Section B 49 (1993) 547–559; doi:10.1107/S0108768193000217

data_2100962
_publ_section_title
;
 Structures of nine histamine H~2~ antagonists related to
 <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              547
_journal_page_last               559
_journal_paper_doi               10.1107/S0108768193000217
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C12 H16 Br1 N5'
_chemical_formula_sum            'C12 H16 Br N5'
_chemical_formula_weight         310.2
_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                 101.92(4)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   14.104(8)
_cell_length_b                   12.678(4)
_cell_length_c                   7.812(3)
_cell_volume                     1366.7(11)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    3.177
_exptl_crystal_density_diffrn    1.51
_exptl_crystal_F_000             632
_cod_data_source_file            ha0114.cif
_cod_data_source_block           ha0114h
_cod_original_cell_volume        1366.7
_cod_original_formula_sum        'C12 H16 Br1 N5'
_cod_database_code               2100962
Structures of nine histamine H~2~ antagonists related to <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
Prout, K.; Burns, K.; Watkin, D. J.; Cooper, D. G.; Durant, G. J.; Ganellin, C. R.; Sach, G. S.; Acta Crystallographica Section B 49 (1993) 547–559; doi:10.1107/S0108768193000217

data_2100963
_publ_section_title
;
 Structures of nine histamine H~2~ antagonists related to
 <i>N</i>-cyano-<i>N</i>'-methyl-<i>N</i>''-[4-(2-pyridyl)butyl]guanidine
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              547
_journal_page_last               559
_journal_paper_doi               10.1107/S0108768193000217
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C13 H19 N5 O1,H2 O1'
_chemical_formula_sum            'C13 H21 N5 O2'
_chemical_formula_weight         279.34
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                78.520(10)
_cell_angle_beta                 85.560(10)
_cell_angle_gamma                76.460(10)
_cell_formula_units_Z            2
_cell_length_a                   7.7000(10)
_cell_length_b                   9.3310(10)
_cell_length_c                   10.7670(10)
_cell_volume                     736.66(15)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.095
_exptl_crystal_density_diffrn    1.26
_exptl_crystal_F_000             300
_cod_data_source_file            ha0114.cif
_cod_data_source_block           ha0114i
_cod_original_cell_volume        736.56
_cod_database_code               2100963
Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic acids
Feeder, N.; Jones, W.; Acta Crystallographica Section B 49 (1993) 541–546; doi:10.1107/S0108768193000515

data_2100964
_publ_section_title
;
 Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic
 acids
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              541
_journal_page_last               546
_journal_paper_doi               10.1107/S0108768193000515
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'C11 H13 N O4'
_chemical_formula_weight         223.23
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_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
_cell_angle_beta                 105.33(3)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.1350(10)
_cell_length_b                   24.556(5)
_cell_length_c                   9.496(2)
_cell_volume                     1154.8(4)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.095
_exptl_crystal_density_diffrn    1.28
_exptl_crystal_F_000             472
_cod_data_source_file            hu0416.cif
_cod_data_source_block           hu0416a
_cod_original_cell_volume        1155
_cod_original_formula_sum        'C11 H13 N1 O4'
_cod_database_code               2100964
Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic acids
Feeder, N.; Jones, W.; Acta Crystallographica Section B 49 (1993) 541–546; doi:10.1107/S0108768193000515

data_2100965
_publ_section_title
;
 Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic
 acids
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              541
_journal_page_last               546
_journal_paper_doi               10.1107/S0108768193000515
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'C11 H13 N O3'
_chemical_formula_weight         207.23
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                100.98(2)
_cell_angle_beta                 94.48(5)
_cell_angle_gamma                98.15(5)
_cell_formula_units_Z            2
_cell_length_a                   5.120(6)
_cell_length_b                   6.595(2)
_cell_length_c                   15.786(3)
_cell_volume                     515.0(6)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.091
_exptl_crystal_density_diffrn    1.34
_exptl_crystal_F_000             220
_cod_data_source_file            hu0416.cif
_cod_data_source_block           hu0416b
_cod_original_cell_volume        515
_cod_database_code               2100965
Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic acids
Feeder, N.; Jones, W.; Acta Crystallographica Section B 49 (1993) 541–546; doi:10.1107/S0108768193000515

data_2100966
_publ_section_title
;
 Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic
 acids
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              541
_journal_page_last               546
_journal_paper_doi               10.1107/S0108768193000515
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'C12 H15 N O3'
_chemical_formula_weight         221.26
_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                 82.06(6)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.081(4)
_cell_length_b                   24.066(6)
_cell_length_c                   9.662(4)
_cell_volume                     1170.1(11)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.084
_exptl_crystal_density_diffrn    1.26
_exptl_crystal_F_000             472
_cod_data_source_file            hu0416.cif
_cod_data_source_block           hu0416c
_cod_original_cell_volume        1170
_cod_database_code               2100966
Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic acids
Feeder, N.; Jones, W.; Acta Crystallographica Section B 49 (1993) 541–546; doi:10.1107/S0108768193000515

data_2100967
_publ_section_title
;
 Crystal structures and polymorphism in aliphatic <i>p</i>-amidobenzoic
 acids
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              541
_journal_page_last               546
_journal_paper_doi               10.1107/S0108768193000515
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'C16 H23 N O3'
_chemical_formula_weight         277.36
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                92.79(6)
_cell_angle_beta                 91.13(4)
_cell_angle_gamma                100.04(4)
_cell_formula_units_Z            2
_cell_length_a                   5.1760(10)
_cell_length_b                   6.731(5)
_cell_length_c                   22.127(17)
_cell_volume                     757.9(8)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    0.078
_exptl_crystal_density_diffrn    1.22
_exptl_crystal_F_000             300
_cod_data_source_file            hu0416.cif
_cod_data_source_block           hu0416d
_cod_original_cell_volume        758
_cod_original_formula_sum        'C16 H23 N1 O3'
_cod_database_code               2100967
Salt-bridge formation by <i>Cinchona</i> alkaloids: quininium salicylate monohydrate
Oleksyn, B. J.; Serda, P.; Acta Crystallographica Section B 49 (1993) 530–534; doi:10.1107/S0108768192011832

data_2100968
_publ_section_title
;
 Salt-bridge formation by <i>Cinchona</i> alkaloids: quininium
 salicylate monohydrate
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              530
_journal_page_last               534
_journal_paper_doi               10.1107/S0108768192011832
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C20 H25 N2 O2 1+,C7 H5 O3 1-,H2 O'
_chemical_formula_sum            'C27 H32 N2 O6'
_chemical_formula_weight         480.56
_symmetry_cell_setting           orthorhombic
_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                   6.957(2)
_cell_length_b                   17.1080(10)
_cell_length_c                   20.477(6)
_cell_volume                     2437.2(10)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.5418
_exptl_absorpt_coefficient_mu    0.7194
_exptl_crystal_density_diffrn    1.31
_exptl_crystal_density_meas      1.300(10)
_exptl_crystal_F_000             1024
_cod_data_source_file            ka0021.cif
_cod_data_source_block           ka0021a
_cod_depositor_comments
;
 Adding the _atom_site_type_symbol data item.

 Antanas Vaitkus,
 2017-01-30
;
_cod_original_cell_volume        2437.0(10)
_cod_database_code               2100968
A two-wavelength crystallographic study of a new aluminophosphate containing nickel
Helliwell, M.; Gallois, B.; Kariuki, B. M.; Kaucic, V.; Helliwell, J. R.; Acta Crystallographica Section B 49 (1993) 420–428; doi:10.1107/S0108768192011042

data_2100969
_publ_section_title
;
 A two-wavelength crystallographic study of a new aluminophosphate
 containing nickel
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              420
_journal_page_last               428
_journal_paper_doi               10.1107/S0108768192011042
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C4 H19 Al3 N4 Ni O17 P4,H2 O'
_chemical_formula_sum            'C4 H21 Al3 N4 Ni O18 P4'
_chemical_formula_weight         676.77
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_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
_cell_angle_beta                 101.216(5)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.0209(8)
_cell_length_b                   15.6610(10)
_cell_length_c                   14.0914(8)
_cell_volume                     2169.3(5)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.54178
_exptl_absorpt_coefficient_mu    6.213
_exptl_crystal_density_diffrn    2.062
_exptl_crystal_F_000             1376
_cod_data_source_file            li0137.cif
_cod_database_code               2100969
A two-wavelength crystallographic study of a new aluminophosphate containing nickel
Helliwell, M.; Gallois, B.; Kariuki, B. M.; Kaucic, V.; Helliwell, J. R.; Acta Crystallographica Section B 49 (1993) 420–428; doi:10.1107/S0108768192011042

data_2100970
_publ_section_title
;
 A two-wavelength crystallographic study of a new aluminophosphate
 containing nickel
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              420
_journal_page_last               428
_journal_paper_doi               10.1107/S0108768192011042
_journal_volume                  49
_journal_year                    1993
_chemical_formula_moiety         'C4 H19 Al3 N4 Ni O17 P4,H2 O'
_chemical_formula_sum            'C4 H21 Al3 N4 Ni O18 P4'
_chemical_formula_weight         676.77
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
_space_group_name_H-M_alt        'P 1 21/n 1'
_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
_cell_angle_beta                 101.30(10)
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   10.03(2)
_cell_length_b                   15.67(2)
_cell_length_c                   14.14(2)
_cell_volume                     2180(5)
_diffrn_radiation_type           Mo
_diffrn_radiation_wavelength     0.71069
_exptl_absorpt_coefficient_mu    1.391
_exptl_crystal_density_diffrn    2.062
_exptl_crystal_F_000             1376
_cod_data_source_file            li0137.cif
_cod_database_code               2100970
Peptide with built-in conformational constraints: structure of Z-(Aib)~7~-O^<i>t^</i>Bu
Vlassi, M.; Brueckner, H.; Kokkinidis, M.; Acta Crystallographica Section B 49 (1993) 560–564; doi:10.1107/S0108768192007171

data_2100971
_publ_section_title
;
 Peptide with built-in conformational constraints: structure of
 Z-(Aib)~7~-O^<i>t^</i>Bu
;
_journal_issue                   3
_journal_name_full               'Acta Crystallographica Section B'
_journal_page_first              560
_journal_page_last               564
_journal_paper_doi               10.1107/S0108768192007171
_journal_volume                  49
_journal_year                    1993
_chemical_formula_sum            'C40 H65 N7 O10'
_chemical_formula_weight         803.1
_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
_space_group_name_H-M_alt        'P -1'
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                87.32(3)
_cell_angle_beta                 77.00(3)
_cell_angle_gamma                79.70(2)
_cell_formula_units_Z            2
_cell_length_a                   10.082(3)
_cell_length_b                   15.523(5)
_cell_length_c                   16.301(5)
_cell_volume                     2445.7(8)
_diffrn_radiation_type           Cu
_diffrn_radiation_wavelength     1.5418
_exptl_absorpt_coefficient_mu    0.61
_exptl_crystal_density_diffrn    1.09
_exptl_crystal_F_000             868
_cod_data_source_file            mu0298.cif
_cod_database_code               2100971