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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/40/1534030.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_1534030
loop_
_publ_author_name
'Poltavets, V.'
'Jansen, M.'
'Vidyasagar, K.'
_publ_section_title
;
 Crystal structures and magnetic properties of Ca Sbx Mn1-x O3 perovskites
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              1285
_journal_page_last               1291
_journal_volume                  177
_journal_year                    2004
_chemical_formula_sum            'Ca Mn0.9 O3 Sb0.1'
_chemical_name_systematic        'Ca ((Sb0.1 Mn0.9) O3)'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.3096
_cell_length_b                   7.5095
_cell_length_c                   5.3316
_cell_volume                     212.584
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Poltavets_JSSCBI_2004_1654.cif
_cod_data_source_block           Ca1Mn0.9O3Sb0.1
_cod_original_cell_volume        212.5839
_cod_original_formula_sum        'Ca1 Mn0.9 O3 Sb0.1'
_cod_database_code               1534030
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+1/2,-y,z+1/2
x+1/2,-y+1/2,-z+1/2
-x,y+1/2,-z
-x,-y,-z
x-1/2,y,-z-1/2
-x-1/2,y-1/2,z-1/2
x,-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
Ca1 Ca+2 0.0003 0.25 0.0304 1 0.0
Sb1 Sb+5 0.5 0 0 0.1 0.0
O2 O-2 0.297 -0.0265 0.283 1 0.0
Mn1 Mn+3 0.5 0 0 0.9 0.0
O1 O-2 -0.086 0.25 0.492 1 0.0
