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#$Date: 2015-07-07 13:46:23 +0300 (Tue, 07 Jul 2015) $
#$Revision: 140619 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/09/1520997.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_1520997
loop_
_publ_author_name
'Field, M.'
'Hunter, B.A.'
'Kennedy, B.J.'
_publ_section_title
;
 Structural studies of the metal-nonmetal transition in Ru pyrochlores
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              25
_journal_page_last               30
_journal_volume                  151
_journal_year                    2000
_chemical_formula_sum            'Bi1.25 Nd0.75 O6.955 Ru2'
_chemical_name_systematic        '(Bi1.25 Nd0.75) Ru2 O6.955'
_space_group_IT_number           227
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'
_symmetry_space_group_name_H-M   'F d -3 m :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   10.3175
_cell_length_b                   10.3175
_cell_length_c                   10.3175
_cell_volume                     1098.306
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Field_JSSCBI_2000_1864.cif
_cod_data_source_block           Bi1.25Nd0.75O6.955Ru2
_cod_database_code               1520997
loop_
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x,y,z
-y,x+1/4,z+1/4
-x+3/4,-y+1/4,z+1/2
y+3/4,-x,z+3/4
x,-y+1/4,-z+1/4
y+3/4,x+1/4,-z+1/2
-x+3/4,y,-z+3/4
-y,-x,-z
z,x,y
-x,z+1/4,y+1/4
-z+3/4,-x+1/4,y+1/2
x+3/4,-z,y+3/4
z,-x+1/4,-y+1/4
x+3/4,z+1/4,-y+1/2
-z+3/4,x,-y+3/4
-x,-z,-y
y,z,x
y+1/2,-z+3/4,-x+1/4
z+1/4,y+3/4,-x+1/2
-y+1/4,z+1/2,-x+3/4
-z,-y+1/2,-x+1/2
-y+1/4,-z+1/4,x
z+1/4,-y,x+1/4
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-x,-y,-z
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-x,y-1/4,z-1/4
-y-3/4,-x-1/4,z-1/2
x-3/4,-y,z-3/4
y,x,z
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x,z,y
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-y-3/4,x+1/2,-z-1/4
-x,y+1/4,z+1/4
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x-3/4,-y+1/2,z-1/4
y,x+1/2,z+1/2
-z,-x+1/2,-y+1/2
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-x-3/4,z+1/2,-y-1/4
-z,x+1/4,y+1/4
-x-3/4,-z+1/4,y
z-3/4,-x+1/2,y-1/4
x,z+1/2,y+1/2
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y-1/4,-z,x-1/4
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z+1/2,x+1/2,y
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z-1/4,-x+1/2,y-3/4
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-z+1/4,y+1/2,-x-1/4
z,-y+1/4,-x-3/4
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 0.3271 0.125 0.125 1 0.0
O2 O-2 0.375 0.375 0.375 0.955 0.0
Nd1 Nd+3 0.5 0.5 0.5 0.375 0.0
Ru1 Ru+3 0 0 0 1 0.0
Bi1 Bi+3 0.5 0.5 0.5 0.625 0.0
