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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/85/1528576.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_1528576
loop_
_publ_author_name
'Hirva, P.'
'Haukka, M.'
'Jakonen, M.'
'Pakkanen, T.A.'
_publ_section_title
;
 Growth of the metal framework in linear ruthenium and osmium carbonyls
;
_journal_name_full               'Inorganica Chimica Acta'
_journal_page_first              853
_journal_page_last               862
_journal_volume                  359
_journal_year                    2006
_chemical_formula_sum            'C4 Cl2 O4 Os'
_chemical_name_systematic        'Os (C O)4 Cl2'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-C 2yc'
_symmetry_space_group_name_H-M   'C 1 2/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 96.452
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.6329
_cell_length_b                   10.2397
_cell_length_c                   11.7025
_cell_volume                     789.787
_citation_journal_id_ASTM        ICHAA3
_cod_data_source_file            Hirva_ICHAA3_2006_766.cif
_cod_data_source_block           C4Cl2O4Os1
_cod_original_cell_volume        789.7869
_cod_original_formula_sum        'C4 Cl2 O4 Os1'
_cod_database_code               1528576
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z+1/2
-x,-y,-z
x,-y,z-1/2
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x+1/2,-y+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
Os1 Os+2 0 0.432035 0.25 1 0.0
Cl1 Cl-1 0.12865 0.60194 0.13356 1 0.0
C2 C+2 0.0934 0.3012 0.1511 1 0.0
O1 O-2 -0.4237 0.4352 0.1082 1 0.0
C1 C+2 -0.2698 0.4352 0.1563 1 0.0
O2 O-2 0.144 0.2217 0.0931 1 0.0
