#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/83/1528329.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_1528329
loop_
_publ_author_name
'Azad, A.K.'
'Eriksson, A.'
'Eriksson, S.G.'
'Khan, A.'
'Tseggai, M.'
_publ_section_title
;
 Electron doping effect on structural and magnetic phase transistions in
 Sr(2-x) Nd(x) Fe Mo O6
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1303
_journal_page_last               1311
_journal_volume                  179
_journal_year                    2006
_chemical_formula_sum            'Fe Mo Nd0.4 O6 Sr1.6'
_chemical_name_systematic        'Sr1.6 Nd0.4 Fe Mo 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                 89.72
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   5.5609
_cell_length_b                   5.5578
_cell_length_c                   7.8884
_cell_volume                     243.799
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Azad_JSSCBI_2006_948.cif
_cod_data_source_block           Fe1Mo1Nd0.4O6Sr1.6
_cod_original_cell_volume        243.7989
_cod_original_sg_symbol_Hall     '-P 2ybc (x-z,y,z)'
_cod_original_formula_sum        'Fe1 Mo1 Nd0.4 O6 Sr1.6'
_cod_database_code               1528329
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
O3 O-2 0.5522 -0.0005 0.2456 1 0.0
Sr1 Sr+2 -0.0005 0.0144 0.2554 0.8 0.0
O2 O-2 0.2751 0.2685 0.4779 1 0.0
Mo1 Mo+5 0.5 0 0 1 0.0
Nd1 Nd+3 -0.0005 0.0144 0.2554 0.2 0.0
Fe1 Fe+2 0 0.5 0 1 0.0
O1 O-2 0.2605 0.2621 0.0131 1 0.0
