#------------------------------------------------------------------------------
#$Date: 2015-10-10 02:39:58 +0300 (Sat, 10 Oct 2015) $
#$Revision: 163878 $
#$URL: svn://www.crystallography.net/cod/cif/8/10/40/8104069.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_8104069
loop_
_publ_author_name
'Wang, P.-L.'
'Werner, P.E.'
'Nord, A.G.'
_publ_section_title
;
 Cation distribution studies of Mg, Co and Co, Ni orthovanadate solid
 solutions
;
_journal_name_full
'Zeitschrift fuer Kristallographie (149,1979-)'
_journal_page_first              271
_journal_page_last               276
_journal_volume                  198
_journal_year                    1992
_chemical_formula_sum            'Co1.5 Ni1.5 O8 V2'
_chemical_name_systematic        '(Co1.5 Ni1.5) (V O4)2'
_space_group_IT_number           64
_symmetry_space_group_name_Hall  '-C 2ac 2'
_symmetry_space_group_name_H-M   'C m c a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.987
_cell_length_b                   11.437
_cell_length_c                   8.272
_cell_volume                     566.411
_citation_journal_id_ASTM        ZEKRDZ
_cod_data_source_file            Wang_ZEKRDZ_1992_32.cif
_cod_data_source_block           Co1.5Ni1.5O8V2
_cod_original_cell_volume        566.4113
_cod_database_code               8104069
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x,-y,-z
-x+1/2,y,-z+1/2
-x,-y,-z
x-1/2,y,-z-1/2
-x,y,z
x-1/2,-y,z-1/2
x+1/2,y+1/2,z
-x+1,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x+1,y+1/2,-z+1/2
-x+1/2,-y+1/2,-z
x,y+1/2,-z-1/2
-x+1/2,y+1/2,z
x,-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
Ni2 Ni+2 0.25 0.132 0.25 0.51 0.0
Ni1 Ni+2 0 0 0 0.44 0.0
Co1 Co+2 0 0 0 0.56 0.0
O3 O-2 0.268 0.121 -0.002 1 0.0
O2 O-2 0 -0.002 0.254 1 0.0
Co2 Co+2 0.25 0.132 0.25 0.49 0.0
V1 V+5 0 0.378 0.122 1 0.0
O1 O-2 0 0.248 0.23 1 0.0
