#------------------------------------------------------------------------------
#$Date: 2015-10-11 16:50:29 +0200 (dom 11 de oct de 2015) $
#$Revision: 165771 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/75/1537546.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_1537546
loop_
_publ_author_name
'Kozlowski, R.'
'Stadnicka, K.'
_publ_section_title
;
 Defect Structures in the Brannerite-Type Vanadates. IV. The Crystal
 Structure of Mn1-x ()x V2-2x Mo2x O6, x =.53
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              271
_journal_page_last               276
_journal_volume                  39
_journal_year                    1981
_chemical_formula_sum            'Mn0.47 Mo1.06 O6 V0.94'
_chemical_name_systematic        'Mn.47 V.94 Mo1.06 O6'
_space_group_IT_number           5
_symmetry_space_group_name_Hall  'C 2y'
_symmetry_space_group_name_H-M   'C 1 2 1'
_cell_angle_alpha                90
_cell_angle_beta                 112
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   9.412
_cell_length_b                   3.643
_cell_length_c                   6.767
_cell_volume                     215.131
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Kozlowski_JSSCBI_1981_28.cif
_cod_data_source_block           Mn0.47Mo1.06O6V0.94
_cod_original_cell_volume        215.1311
_cod_database_code               1537546
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
x+1/2,y+1/2,z
-x+1/2,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
O3 O-2 0.3084 0.0042 0.4375 1 0.0
O1 O-2 0.1705 0.4444 0.117 1 0.0
O2 O-2 0.4749 0.5237 0.295 1 0.0
V1 V+5 0.31392 0.5018 0.3502 0.47 0.0
Mo1 Mo+6 0.31392 0.5018 0.3502 0.53 0.0
Mn1 Mn+2 0 0 0 0.47 0.0
