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#$Date: 2018-09-24 16:40:44 +0300 (Mon, 24 Sep 2018) $
#$Revision: 211138 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/53/06/1530684.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_1530684
loop_
_publ_author_name
'Salomov, A.S.'
'Sharipov, Kh.T.'
'Svetlov, A.A.'
'Parpiev, N.A.'
'Mikhailov, Yu.N.'
'Kanishcheva, A.S.'
'Porai-Koshits, M.A.'
'Sinitsyn, N.M.'
_publ_section_title
;
 Crystal structure of monohydrates of pentafluoronitrosyl complexes of
 osmium and ruthenium
;
_journal_name_full
;
Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))
;
_journal_page_first              1285
_journal_page_last               1288
_journal_volume                  10
_journal_year                    1984
_chemical_formula_sum            'Cs2 F5 H2 N O2 Os'
_chemical_name_systematic        'Cs2 (Os (N O) F5) (H2 O)'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.75
_cell_length_b                   19.534
_cell_length_c                   6.787
_cell_volume                     894.896
_citation_journal_id_ASTM        KOKHDC
_cod_data_source_file            Salomov_KOKHDC_1984_1215.cif
_cod_data_source_block           H2Cs2F5N1O2Os1
_cod_depositor_comments
;
 Marking attached hydrogen atoms.

 Antanas Vaitkus,
 2018-09-24
;
_cod_original_cell_volume        894.8965
_cod_original_formula_sum        'H2 Cs2 F5 N1 O2 Os1'
_cod_database_code               1530684
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
x,-y,-z
-x,y,-z+1/2
-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
-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_attached_hydrogens
_atom_site_U_iso_or_equiv
Os1 Os+4 0 0.13912 0.25 1 0 0.0
Cs1 Cs+1 0 0.40049 0.25 1 0 0.0
Cs2 Cs+1 0.5 0.25511 0.25 1 0 0.0
N1 N+1 0 0.0534 0.25 1 0 0.0
O1 O-2 0 -0.0086 0.25 1 0 0.0
O2 O-2 0.5 -0.055 -0.25 1 2 0.0
F1 F-1 0 0.2388 0.25 1 0 0.0
F2 F-1 0.2112 0.1485 0.0481 1 0 0.0
