#------------------------------------------------------------------------------
#$Date: 2015-10-05 12:16:51 +0200 (lun 05 de oct de 2015) $
#$Revision: 159898 $
#$URL: svn://www.crystallography.net/cod/cif/7/22/24/7222416.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_7222416
loop_
_publ_author_name
'Haas, F.'
'Fuess, H.'
'Adams, A.H.'
'Schimanke, G.'
'Martin, M.'
'Buhrmester, T.'
_publ_section_title
;
 X-ray absorption and X-ray diffraction studies on molybdenum doped
 vanadium pentoxide
;
_journal_name_full               'Physical Chemistry Chemical Physics'
_journal_page_first              4317
_journal_page_last               4324
_journal_volume                  5
_journal_year                    2003
_chemical_formula_sum            'Mo0.12 O5 V1.88'
_chemical_name_systematic        '(V0.94 Mo0.06)2 O5'
_space_group_IT_number           59
_symmetry_space_group_name_Hall  '-P 2ab 2a'
_symmetry_space_group_name_H-M   'P m m n :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   11.5439
_cell_length_b                   3.5714
_cell_length_c                   4.3362
_cell_volume                     178.772
_citation_journal_id_ASTM        PPCPFQ
_cod_data_source_file            Haas_PPCPFQ_2003_1970.cif
_cod_data_source_block           Mo0.12O5V1.88
_cod_original_cell_volume        178.7724
_cod_database_code               7222416
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y+1/2,z
x+1/2,-y,-z
-x,y+1/2,-z
-x,-y,-z
x-1/2,y-1/2,-z
-x-1/2,y,z
x,-y-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
O2 O-2 -0.0718 0.25 -0.0012 1 0.0
O3 O-2 0.25 0.25 -0.0127 1 0.0
Mo1 Mo+6 0.1008 0.25 0.8945 0.06 0.0
V1 V+4 0.1008 0.25 0.8945 0.94 0.0
O1 O-2 0.1049 0.25 0.5322 1 0.0
