#------------------------------------------------------------------------------
#$Date: 2016-09-16 17:09:56 +0200 (vie 16 de sep de 2016) $
#$Revision: 186594 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/96/1529669.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_1529669
loop_
_publ_author_name
'Bokii, G.B.'
'Porai-Koshits, M.A.'
_publ_section_title
;
 The crystal structure of Gros' salt (Pt (N H3)4 Cl2) Cl2
;
_journal_name_full               'Doklady Akademii Nauk SSSR'
_journal_page_first              337
_journal_page_last               339
_journal_volume                  64
_journal_year                    1949
_chemical_formula_sum            'Cl4 H12 N4 Pt'
_chemical_name_systematic        '(Pt (N H3)4 Cl2) Cl2'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   7.44
_cell_length_b                   7.44
_cell_length_c                   7.98
_cell_volume                     441.722
_citation_journal_id_ASTM        DANKAS
_cod_data_source_file            Bokii_DANKAS_1949_1974.cif
_cod_data_source_block           H12Cl4N4Pt1
_cod_original_cell_volume        441.7217
_cod_original_formula_sum        'H12 Cl4 N4 Pt1'
_cod_database_code               1529669
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+1/2,z+1/2
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
N1 N-3 0.194 0.194 0 1 0.0 3
Cl1 Cl-1 0 0 0.281 1 0.0 0
Cl2 Cl-1 0.5 0 0 1 0.0 0
Pt1 Pt+4 0 0 0 1 0.0 0
