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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/11/1531102.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_1531102
loop_
_publ_author_name
'Azad, A.K.'
'Ivanov, S.A.'
'Eriksson, S.G.'
'Mellergard, A.'
'Eriksen, J.'
'Rundlof, H.'
_publ_section_title
;
 A study on the nuclear and magnetic structure of the double perovskites
 A2 Fe W O6 (A = Sr, Ba) by neutron powder diffraction and reverse Monte
 Carlo modelling
;
_journal_name_full               'Materials Research Bulletin'
_journal_page_first              1797
_journal_page_last               1813
_journal_volume                  37
_journal_year                    2002
_chemical_formula_sum            'Fe O6 Sr2 W'
_chemical_name_systematic        'Sr2 (Fe W O6)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2yn'
_symmetry_space_group_name_H-M   'P 1 21/n 1'
_cell_angle_alpha                90
_cell_angle_beta                 89.99
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.648
_cell_length_b                   5.6088
_cell_length_c                   7.9362
_cell_volume                     251.407
_citation_journal_id_ASTM        MRBUAC
_cod_data_source_file            Azad_MRBUAC_2002_776.cif
_cod_data_source_block           Fe1O6Sr2W1
_cod_original_cell_volume        251.4069
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Fe1 O6 Sr2 W1'
_cod_database_code               1531102
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,y+1/2,-z+1/2
-x,-y,-z
x-1/2,-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
Fe1 Fe+2 0.5 0 0.5 1 0.0
O2 O-2 0.241 0.778 0.0309 1 0.0
Sr1 Sr+2 -0.0024 -0.0112 0.751 1 0.0
O1 O-2 0.28 0.261 0.0205 1 0.0
W1 W+6 0.5 0 0 1 0.0
O3 O-2 0.0495 0.507 0.739 1 0.0
