#------------------------------------------------------------------------------
#$Date: 2018-09-27 06:13:35 +0200 (jue 27 de sep de 2018) $
#$Revision: 211196 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/90/1529000.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_1529000
loop_
_publ_author_name
'Will, G.'
_publ_section_title
;
 Zur Kristallstruktur von Er Fe O3
;
_journal_name_full               Naturwissenschaften
_journal_page_first              609
_journal_page_last               610
_journal_volume                  53
_journal_year                    1966
_chemical_formula_sum            'Er Fe 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                   5.267
_cell_length_b                   5.581
_cell_length_c                   7.593
_cell_volume                     223.197
_citation_journal_id_ASTM        NATWAY
_cod_data_source_file            Will_NATWAY_1966_288.cif
_cod_data_source_block           Er1Fe1O3
_cod_original_cell_volume        223.1972
_cod_original_sg_symbol_Hall     '-P 2ac 2n (z,x,y)'
_cod_original_formula_sum        'Er1 Fe1 O3'
_cod_database_code               1529000
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
O2 O-2 -0.315 0.314 0.052 1 0.0
Fe1 Fe+3 0.5 0 0 1 0.0
Er1 Er+3 -0.021 0.068 0.25 1 0.0
O1 O-2 0.062 0.479 0.25 1 0.0
