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#$Date: 2015-09-08 22:49:40 +0200 (mar 08 de sep de 2015) $
#$Revision: 155453 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/03/1530368.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_1530368
loop_
_publ_author_name
'Mattes, R.'
'Forster, H.'
_publ_section_title
;
 Structural and spectroscopic studies of Cs3 V2 O4 F5 and of isostructural
 phases in the Cs3 Mo2 O6 F3 Cs3 V2 O2 F7 and Cs3 Mo2 O6 F3 - Cs3 V2 O4 F5
 systems
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              237
_journal_page_last               247
_journal_volume                  87
_journal_year                    1982
_chemical_formula_sum            'Cs3 F6.0003 Mo0.66 O2.9997 V1.46'
_chemical_name_systematic        'Cs3 V1.5 Mo.5 O3 F6'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   6.359
_cell_length_b                   6.359
_cell_length_c                   14.999
_cell_volume                     525.255
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Mattes_JCOMAH_1982_911.cif
_cod_data_source_block           Cs3F6.0003Mo0.66O2.9997V1.46
_cod_original_cell_volume        525.2555
_cod_database_code               1530368
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
-y,-x,-z+1/2
x-y,-y,-z
x,x-y,-z+1/2
y,x,-z
-x+y,y,-z+1/2
-x,-x+y,-z
-x,-y,-z
-x+y,-x,-z-1/2
y,-x+y,-z
x,y,-z-1/2
x-y,x,-z
-y,x-y,-z-1/2
y,x,z-1/2
-x+y,y,z
-x,-x+y,z-1/2
-y,-x,z
x-y,-y,z-1/2
x,x-y,z
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
O1 O-2 0.1419 0.2838 0.5951 0.3333 0.0
Mo1 Mo+4 0 0 0.146 0.33 0.0
F2 F-1 0.1315 0.263 0.25 0.6667 0.0
Cs1 Cs+1 0.3333 0.6667 0.4321 1 0.0
Cs2 Cs+1 0.3333 0.6667 0.75 1 0.0
V1 V+4 0 0 0.146 0.73 0.0
F1 F-1 0.1419 0.2838 0.5951 0.6667 0.0
O2 O-2 0.1315 0.263 0.25 0.3333 0.0
