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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/90/1539090.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_1539090
loop_
_publ_author_name
'Shirane, G.'
'Pickart, S.J.'
'Nathans, R.'
'Ishikawa, Y.'
_publ_section_title
;
 Neutron-diffraction study of antiferromagnetic Fe Ti O3 and its solid
 solutions with alpha-Fe2 O3
;
_journal_name_full               'Journal of Physics and Chemistry of Solids'
_journal_page_first              35
_journal_page_last               43
_journal_volume                  10
_journal_year                    1959
_chemical_formula_sum            'Fe O3 Ti'
_chemical_name_systematic        'Fe (Ti O3)'
_space_group_IT_number           148
_symmetry_space_group_name_Hall  '-P 3*'
_symmetry_space_group_name_H-M   'R -3 :R'
_cell_angle_alpha                54.68
_cell_angle_beta                 54.68
_cell_angle_gamma                54.68
_cell_formula_units_Z            2
_cell_length_a                   5.538
_cell_length_b                   5.538
_cell_length_c                   5.538
_cell_volume                     105.215
_citation_journal_id_ASTM        JPCSAW
_cod_data_source_file            Shirane_JPCSAW_1959_277.cif
_cod_data_source_block           Fe1O3Ti1
_cod_original_sg_symbol_Hall     '-R 3 (-y+z,x+z,-x+y+z)'
_cod_original_formula_sum        'Fe1 O3 Ti1'
_cod_database_code               1539090
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
z,x,y
y,z,x
-x,-y,-z
-z,-x,-y
-y,-z,-x
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
O1 O-2 0.555 -0.04 0.235 1 0.0
Ti1 Ti+4 0.142 0.142 0.142 1 0.0
Fe1 Fe+2 0.358 0.358 0.358 1 0.0
