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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/1/52/58/1525829.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_1525829
loop_
_publ_author_name
'Lobanov, M.V.'
'D'yachenko, O.G.'
'Balagurov, A.M.'
'Pomjakushin, V.Yu.'
'Fischer, P.'
'Lebedev, O.I.'
'Abakumov, A.M.'
'Gutmann, M.'
'Antipov, E.V.'
'van Tendeloo, G.'
_publ_section_title
;
 Structural and magnetic properties of the colossal magnetoresistance
 perovskite La0.85 Ca0.15 Mn o3
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              8941
_journal_page_last               8949
_journal_volume                  61
_journal_year                    2000
_chemical_formula_sum            'Ca0.15 La0.85 Mn O3'
_chemical_name_systematic        '(La0.85 Ca0.15) (Mn O3)'
_space_group_IT_number           14
_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
_cell_angle_alpha                90
_cell_angle_beta                 90.091
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   7.74476
_cell_length_b                   5.50398
_cell_length_c                   5.47351
_cell_volume                     233.319
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Lobanov_PRBMDO_2000_476.cif
_cod_data_source_block           Ca0.15La0.85Mn1O3
_cod_original_formula_sum        'Ca0.15 La0.85 Mn1 O3'
_cod_database_code               1525829
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z+1/2
-x,-y,-z
x,-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
Ca1 Ca+2 0.2483 -0.0033 -0.0174 0.15 0.0
O1 O-2 0.2465 0.0637 0.5013 1 0.0
Mn1 Mn+3 0 0 0.5 1 0.0
O2 O-2 0.0315 0.7363 0.723 1 0.0
Mn2 Mn+3 0.5 0 0.5 1 0.0
La1 La+3 0.2483 -0.0033 -0.0174 0.85 0.0
O3 O-2 0.4671 0.7747 0.2319 1 0.0
