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#$Date: 2015-07-12 17:16:34 +0300 (Sun, 12 Jul 2015) $
#$Revision: 146723 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/56/1525692.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_1525692
loop_
_publ_author_name
'Blasco, J.'
'Ritter, C.'
'Garcia, J.'
'de Teresa, J.M.'
'Perez-Cacho, J.'
'Ibarra, M.R.'
_publ_section_title
;
 Structural and magnetic study of Tb1-x Cax Mn O3 perovskites
;
_journal_name_full
'Physical Review, Serie 3. B - Condensed Matter (18,1978-)'
_journal_page_first              5609
_journal_page_last               5618
_journal_volume                  62
_journal_year                    2000
_chemical_formula_sum            'Ca0.33 Mn O3 Tb0.67'
_chemical_name_systematic        '(Tb0.67 Ca0.33) (Mn 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                   5.3266
_cell_length_b                   5.5367
_cell_length_c                   7.4628
_cell_volume                     220.091
_citation_journal_id_ASTM        PRBMDO
_cod_data_source_file            Blasco_PRBMDO_2000_492.cif
_cod_data_source_block           Ca0.33Mn1O3Tb0.67
_cod_cif_authors_sg_Hall         '-P 2ac 2n (z,x,y)'
_cod_original_cell_volume        220.0913
_cod_chemical_formula_sum_orig   'Ca0.33 Mn1 O3 Tb0.67'
_cod_database_code               1525692
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 1 0.0
O2 O-2 0.7042 0.3013 0.0448 1 0.0
O1 O-2 0.09 0.4727 0.25 1 0.0
Ca1 Ca+2 -0.0127 0.063 0.25 0.33 0.0
Tb1 Tb+3 -0.0127 0.063 0.25 0.67 0.0