#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/83/1528304.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_1528304
loop_
_publ_author_name
'Alvarez-Serrano, I.'
'Veiga, M.L.'
'Pico, C.'
'Lopez, M.L.'
_publ_section_title
;
 CMR in a manganite with 50% of Ti in Mn sites
;
_journal_name_full               'Solid State Sciences'
_journal_page_first              37
_journal_page_last               43
_journal_volume                  8
_journal_year                    2006
_chemical_formula_sum            'La0.94 Mn O6 Sr0.94 Ti'
_chemical_name_systematic        'Sr0.94 La0.94 Mn Ti O6'
_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            2
_cell_length_a                   5.5031
_cell_length_b                   5.4653
_cell_length_c                   7.7961
_cell_volume                     234.476
_citation_journal_id_ASTM        SSSCFJ
_cod_data_source_file            Alvarez-Serrano_SSSCFJ_2006_689.cif
_cod_data_source_block           La0.94Mn1O6Sr0.94Ti1
_cod_original_cell_volume        234.4762
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'La0.94 Mn1 O6 Sr0.94 Ti1'
_cod_database_code               1528304
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
Mn1 Mn+3 0.5 0 0 0.5 0.0
O2 O-2 0.743 0.258 0.021 1 0.0
La1 La+3 0.006 0.02 0.25 0.474 0.0
Ti1 Ti+4 0.5 0 0 0.5 0.0
Sr1 Sr+2 0.006 0.02 0.25 0.474 0.0
O1 O-2 0.044 0.498 0.25 1 0.0
