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#$Date: 2015-07-12 21:50:58 +0300 (Sun, 12 Jul 2015) $
#$Revision: 148245 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/69/1526958.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_1526958
loop_
_publ_author_name
'Wu, C.-D.'
'Lin, X.'
'Yang, W.-B.'
'Lu, C.-Z.'
'Zhuang, H.-H.'
_publ_section_title
;
 A novel Mo-doped compound with graphite-like structure: (H3 O)2 V3 O8
;
_journal_name_full               'Jiegon Huaxue'
_journal_page_first              462
_journal_page_last               465
_journal_volume                  20
_journal_year                    2001
_chemical_formula_sum            'H6 O10 V3'
_chemical_name_systematic        '(H3 O)2 V3 O8'
_space_group_IT_number           100
_symmetry_space_group_name_Hall  'P 4 -2ab'
_symmetry_space_group_name_H-M   'P 4 b m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.904
_cell_length_b                   8.904
_cell_length_c                   5.573
_cell_volume                     441.834
_citation_journal_id_ASTM        JHUADF
_cod_data_source_file            Wu_JHUADF_2001_1798.cif
_cod_data_source_block           H6O10V3
_cod_original_cell_volume        441.8342
_cod_database_code               1526958
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
-x+1/2,y+1/2,z
-y+1/2,-x+1/2,z
x+1/2,-y+1/2,z
y+1/2,x+1/2,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
V2 V+4 0 0 0.2559 1 0.0
O5 O-2 0.6694 0.1694 0.7914 1 0.0
O4 O-2 0.5 0 0.1484 1 0.0
V1 V+5 0.3665 0.1335 0.259 1 0.0
O3 O-2 0.3696 0.1304 0.5605 1 0.0
O2 O-2 0.1929 0.0848 0.1543 1 0.0
O1 O-2 0 0 0.5451 1 0.0
