#------------------------------------------------------------------------------
#$Date: 2016-09-16 17:09:56 +0200 (vie 16 de sep de 2016) $
#$Revision: 186594 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/74/1527405.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_1527405
loop_
_publ_author_name
'Gee, R.J.D.'
'Powell, H.M.'
_publ_section_title
;
 The crystal and molecular structure of ammonium
 mue-nitrido-bis(aquotetrachlororuthenate(IV))
;
_journal_name_full
;
Journal of the Chemical Society A: Inorganic, Physical, Theoretical (1966-1971)
;
_journal_page_first              1795
_journal_page_last               1797
_journal_volume                  1971
_journal_year                    1971
_chemical_formula_sum            'Cl8 H16 N4 O2 Ru2'
_chemical_name_systematic        '(N H4)3 (N (Ru Cl4 (H2 O))2)'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-B 2'
_symmetry_space_group_name_H-M   'B 1 1 2/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                121.09
_cell_formula_units_Z            2
_cell_length_a                   15.91
_cell_length_b                   8.399
_cell_length_c                   7.642
_cell_volume                     874.500
_citation_journal_id_ASTM        JCSIAP
_cod_data_source_file            Gee_JCSIAP_1971_1853.cif
_cod_data_source_block           H16Cl8N4O2Ru2
_cod_original_cell_volume        874.4999
_cod_original_sg_symbol_Hall     '-C 2y (-x,z,y)'
_cod_original_formula_sum        'H16 Cl8 N4 O2 Ru2'
_cod_database_code               1527405
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
-x,-y,-z
x,y,-z
x+1/2,y,z+1/2
-x+1/2,-y,z+1/2
-x+1/2,-y,-z+1/2
x+1/2,y,-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
N2 N-3 0 0 0.5 1 0.0 4
N1 N-3 0 0 0 1 0.0 0
N3 N-3 0.1392 0.5314 0 1 0.0 4
Cl2 Cl-1 0.06702 0.77912 0.22114 1 0.0 0
O1 O-2 0.2424 0.0214 0 1 0.0 2
Ru1 Ru+4 0.11118 0.01049 0 1 0.0 0
Cl1 Cl-1 0.18125 0.24201 0.22027 1 0.0 0
