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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/1/52/68/1526872.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_1526872
loop_
_publ_author_name
'Vasylechko, L.'
'Matkovskii, A.'
'Borrmann, H.'
'Niewa, R.'
'Knapp, M.'
'Bismayer, U.'
'Savytskii, D.'
'Berkowski, M.'
_publ_section_title
;
 R3-c - Pbnm phase transition of La1-x Smx Ga O3 (0 < x < 0.3) perovskites
 and crystal structures of the orthorhombic and trigonalphases
;
_journal_name_full               'Solid State Ionics'
_journal_page_first              219
_journal_page_last               227
_journal_volume                  143
_journal_year                    2001
_chemical_formula_sum            'Ga La0.9 O3 Sm0.1'
_chemical_name_systematic        '(La0.9 Sm0.1) Ga O3'
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2c 2ab'
_symmetry_space_group_name_H-M   'P b n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   5.51224
_cell_length_b                   5.49248
_cell_length_c                   7.77059
_cell_volume                     235.261
_citation_journal_id_ASTM        SSIOD3
_cod_data_source_file            Vasylechko_SSIOD3_2001_1953.cif
_cod_data_source_block           Ga1La0.9O3Sm0.1
_cod_original_cell_volume        235.2613
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'Ga1 La0.9 O3 Sm0.1'
_cod_database_code               1526872
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z+1/2
-x,-y,z+1/2
-x,-y,-z
-x-1/2,y-1/2,z
x-1/2,-y-1/2,z-1/2
x,y,-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
La1 La+3 -0.0048 0.0224 0.25 0.9 0.0
O2 O-2 0.7273 0.2731 0.0393 1 0.0
Ga1 Ga+3 0.5 0 0 1 0.0
O1 O-2 0.0749 0.4957 0.25 1 0.0
Sm1 Sm+3 -0.0048 0.0224 0.25 0.1 0.0
