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#$Date: 2016-12-12 16:02:45 +0200 (Mon, 12 Dec 2016) $
#$Revision: 189075 $
#$URL: file:///home/coder/svn-repositories/cod/cif/4/34/42/4344277.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_4344277
loop_
_publ_author_name
'Druding, L.F.'
'Sancilio, F.D.'
'Lukaszweski, D.M.'
_publ_section_title
;
 Triammines of Cobalt(III). IV. Preparation, Properties, and Structure of
 the Polymerization Isomer trans-Diazidotetraaminecobalt(III)
 trans-Tetraazidodiamminecobaltate(III), (Co (N H3)4 (N3)2 ) (Co (N H3)2
 (N3)4).
;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              1365
_journal_page_last               1369
_journal_volume                  14
_journal_year                    1975
_chemical_formula_sum            'Co2 H18 N24'
_chemical_name_systematic        '(Co (N H3)4 (N3)2) (Co (N H3)2 (N3)4)'
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_cell_angle_alpha                87.4
_cell_angle_beta                 72.7
_cell_angle_gamma                116.4
_cell_formula_units_Z            1
_cell_length_a                   7.661
_cell_length_b                   6.928
_cell_length_c                   9.671
_cell_volume                     429.394
_citation_journal_id_ASTM        INOCAJ
_cod_data_source_file            Druding_INOCAJ_1975_1850.cif
_cod_data_source_block           H18Co2N24
_cod_original_formula_sum        'H18 Co2 N24'
_cod_database_code               4344277
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
_atom_site_attached_hydrogens
N4 N 0.0621 0.9394 0.7982 1 0.0 0
N10 N 0.4743 0.064 0.2836 1 0.0 0
N7 N-3 0.2553 0.0065 0.0132 1 0.0 3
N1 N 0.1529 0.3166 0.9143 1 0.0 0
N11 N-3 -0.1668 0.3992 0.3719 1 0.0 3
N9 N 0.3065 0.9278 0.3365 1 0.0 0
Co1 Co+3 0 0 0 1 0.0 0
N5 N 0.1999 0.0867 0.6986 1 0.0 0
N12 N-3 0.2173 0.4382 0.377 1 0.0 3
N6 N 0.3349 0.2241 0.5991 1 0.0 0
Co2 Co+3 0 0.5 0.5 1 0.0 0
N2 N 0.2277 0.4469 0.9833 1 0.0 0
N8 N 0.1231 0.7998 0.3852 1 0.0 0
N3 N 0.3039 0.5781 0.0459 1 0.0 0
