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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/11/1521154.cif $
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#
# 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_1521154
loop_
_publ_author_name
'Hibble, S.J.'
'Cooper, S.P.'
'Fawcett, I.D.'
'Hannon, A.C.'
'Greenblatt, M.'
_publ_section_title
;
 Local distortions in the colossal magnetoresistive manganates La0.70
 Ca0.30 Mn O3, La0.80 Ca0.20 Mn O3 and La0.70 Sr0.30 Mn O3 revealed by
 total neutron diffraction
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              9221
_journal_page_last               9238
_journal_volume                  11
_journal_year                    1999
_chemical_formula_sum            'Ca0.3 La0.7 Mn O3'
_chemical_name_systematic        '(La0.7 Ca0.3) (Mn 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                   5.45917
_cell_length_b                   7.71684
_cell_length_c                   5.47539
_cell_volume                     230.665
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            Hibble_JCOMEL_1999_108.cif
_cod_data_source_block           Ca0.3La0.7Mn1O3
_cod_original_cell_volume        230.6647
_cod_original_formula_sum        'Ca0.3 La0.7 Mn1 O3'
_cod_database_code               1521154
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 0.0198 0.25 0.9955 0.3 0.0
La1 La+3 0.0198 0.25 0.9955 0.7 0.0
O1 O-2 0.4912 0.25 0.0657 1 0.0
O2 O-2 0.2737 0.0322 0.7259 1 0.0
Mn1 Mn+3 0 0 0.5 1 0.0