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#$Date: 2015-09-09 11:35:34 +0300 (Wed, 09 Sep 2015) $
#$Revision: 155529 $
#$URL: svn://www.crystallography.net/cod/cif/4/03/14/4031474.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_4031474
loop_
_publ_author_name
'Milligan, W.O.'
'Mullica, D.F.'
'Hills, F.W.'
_publ_section_title
;
 Cadmium(II) hexacyanochromate(III) tetradecahydrate
;
_journal_name_full               'Journal of Inorganic and Nuclear Chemistry'
_journal_page_first              3119
_journal_page_last               3124
_journal_volume                  43
_journal_year                    1981
_chemical_formula_sum
'C15.9996 H37.3324 Cd3.9999 Cr2.6666 N15.9996 O18.6662'
_chemical_name_systematic        '(Cd3 (Cr (C N)6)2 (H2 O)14)1.3333'
_space_group_IT_number           225
_symmetry_space_group_name_Hall  '-F 4 2 3'
_symmetry_space_group_name_H-M   'F m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   10.961
_cell_length_b                   10.961
_cell_length_c                   10.961
_cell_volume                     1316.893
_citation_journal_id_ASTM        JINCAO
_cod_data_source_file            Milligan_JINCAO_1981_805.cif
_cod_data_source_block
C15.9996H37.3324Cd3.9999Cr2.6666N15.9996O18.6662
_cod_database_code               4031474
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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
Cr1 Cr+3 0 0 0 0.667 0.0
O2 O-2 0 0 0 0.333 0.0
N1 N-3 0 0 0.295 0.667 0.0
O3 O-2 0.171 0.171 0.171 0.167 0.0
C1 C+2 0 0 0.19 0.667 0.0
O1 O-2 0 0 0.283 0.333 0.0
O4 O-2 0.25 0.25 0.25 0.5 0.0
Cd1 Cd+2 0.5 0.5 0.5 1 0.0
