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#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/79/1527959.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_1527959
loop_
_publ_author_name
'Psycharis, V.'
'Christides, C.'
'Anagnostou, M.'
'Niarchos, D.'
_publ_section_title
;
 Rietveld analysis of X-ray powder diffraction patterns for the new Sm
 Fe10 Mo2 Nx nitride compound
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              6122
_journal_page_last               6124
_journal_volume                  70
_journal_year                    1991
_chemical_formula_sum            'Fe10 Mo2 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                   8.5869
_cell_length_b                   8.5869
_cell_length_c                   4.8002
_cell_volume                     353.942
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            Psycharis_JAPIAU_1991_471.cif
_cod_data_source_block           Fe10Mo2Sm1
_cod_original_formula_sum        'Fe10 Mo2 Sm1'
_cod_database_code               1527959
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
Sm1 Sm 0 0 0 1 0.0
Mo3 Mo 0.3601 0 0 0.5 0.0
Fe2 Fe 0.278 0.5 0 1 0.0
Fe3 Fe 0.3601 0 0 0.5 0.0
Fe1 Fe 0.25 0.25 0.25 1 0.0
