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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/19/1541959.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_1541959
loop_
_publ_author_name
'Bukvetskii, B.V.'
'Muradyan, L.A.'
'Davidovich, R.L.'
'Simonov, V.I.'
_publ_section_title
;
 Crystal structure of rubidium tetrafluorovanadate dihydrate Rb V F4 (H2
 O)2
;
_journal_name_full
;
Koordinatsionnaya Khimiya (= Coordination Chemistry (USSR))
;
_journal_page_first              1129
_journal_page_last               1134
_journal_volume                  2
_journal_year                    1976
_chemical_formula_sum            'F4 H4 O2 Rb V'
_chemical_name_systematic        'Rb (V F4) (H2 O)2'
_space_group_IT_number           15
_symmetry_space_group_name_Hall  '-B 2b'
_symmetry_space_group_name_H-M   'B 1 1 2/b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                124.04
_cell_formula_units_Z            4
_cell_length_a                   11.921
_cell_length_b                   9.114
_cell_length_c                   6.343
_cell_volume                     571.066
_citation_journal_id_ASTM        KOKHDC
_cod_data_source_file            Bukvetskii_KOKHDC_1976_579.cif
_cod_data_source_block           H4F4O2Rb1V1
_cod_original_cell_volume        571.0656
_cod_original_sg_symbol_Hall     '-C 2yc (-x,z,y)'
_cod_original_formula_sum        'H4 F4 O2 Rb1 V1'
_cod_database_code               1541959
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y+1/2,z
-x,-y,-z
x,y-1/2,-z
x+1/2,y,z+1/2
-x+1/2,-y+1/2,z+1/2
-x+1/2,-y,-z+1/2
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
F2 F-1 0.2614 0.4262 0.0251 1 0.0
H2 H+1 0.325 0.314 0.101 1 0.0
V1 V+3 0.25 0 0.25 1 0.0
H1 H+1 0.411 0.338 0.221 1 0.0
F1 F-1 0.4115 0.0183 0.3337 1 0.0
Rb1 Rb+1 0 0.25 0.2224 1 0.0
O1 O-2 0.3668 0.2584 0.1415 1 0.0
