#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/26/1522637.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_1522637
loop_
_publ_author_name
'Ohashi, K.'
'Tawara, Y.'
'Shimao, M.'
'Osugi, R.'
_publ_section_title
;
 Magnetic properties of Fe-rich rare-earth intermetallic compounds with a
 Mn12 Th structure
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              5174
_journal_page_last               5716
_journal_volume                  64
_journal_year                    1988
_chemical_formula_sum            'Fe11.004 Sm Ti0.996'
_chemical_name_systematic        '(Fe0.917 Ti0.083)12 Sm'
_space_group_IT_number           139
_symmetry_space_group_name_Hall  '-I 4 2'
_symmetry_space_group_name_H-M   'I 4/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   8.558
_cell_length_b                   8.558
_cell_length_c                   4.793
_cell_volume                     351.036
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            Ohashi_JAPIAU_1988_62.cif
_cod_data_source_block           Fe11.004Sm1Ti0.996
_cod_original_cell_volume        351.0363
_cod_original_formula_sum        'Fe11.004 Sm1 Ti0.996'
_cod_database_code               1522637
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z
y,x,-z
-x,y,-z
-y,-x,-z
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z
-y,-x,z
x,-y,z
y,x,z
x+1/2,y+1/2,z+1/2
-y+1/2,x+1/2,z+1/2
-x+1/2,-y+1/2,z+1/2
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,-z+1/2
-y+1/2,-x+1/2,-z+1/2
-x+1/2,-y+1/2,-z+1/2
y+1/2,-x+1/2,-z+1/2
x+1/2,y+1/2,-z+1/2
-y+1/2,x+1/2,-z+1/2
-x+1/2,y+1/2,z+1/2
-y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,z+1/2
y+1/2,x+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
Ti2 Ti 0.365 0 0 0.083 0.0
Ti3 Ti 0.278 0.5 0 0.083 0.0
Fe3 Fe 0.278 0.5 0 0.917 0.0
Ti1 Ti 0.25 0.25 0.25 0.083 0.0
Fe2 Fe 0.365 0 0 0.917 0.0
Fe1 Fe 0.25 0.25 0.25 0.917 0.0
Sm1 Sm 0 0 0 1 0.0
