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#$Date: 2015-07-11 17:32:24 +0300 (Sat, 11 Jul 2015) $
#$Revision: 145315 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/45/1524538.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_1524538
loop_
_publ_author_name
'Herbst, J.F.'
'Croat, J.J.'
'Lee, R.W.'
'Yelon, W.B.'
_publ_section_title
;
 Neutron diffraction studies of Nd2 (Cox Fe1-x)17 alloys: Preferential
 site occupation and magnetic structure
;
_journal_name_full               'Journal of Applied Physics'
_journal_page_first              250
_journal_page_last               256
_journal_volume                  53
_journal_year                    1982
_chemical_formula_sum            'Co1.7 Fe15.3 Nd2'
_chemical_name_systematic        '(Co1.7 Fe15.3) Nd2'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   8.573
_cell_length_b                   8.573
_cell_length_c                   12.481
_cell_volume                     794.412
_citation_journal_id_ASTM        JAPIAU
_cod_data_source_file            Herbst_JAPIAU_1982_975.cif
_cod_data_source_block           Co1.7Fe15.3Nd2
_cod_original_cell_volume        794.4117
_cod_database_code               1524538
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,z
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+1/3
-x+2/3,-x+y+1/3,-z+1/3
x-y+2/3,-y+1/3,-z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+2/3
-x+1/3,-x+y+2/3,-z+2/3
x-y+1/3,-y+2/3,-z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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
Co2 Co 0.5 0 0.5 0.16 0.0
Fe3 Fe 0.285 0 0 0.94 0.0
Fe4 Fe 0.168 0.832 0.489 0.86 0.0
Co1 Co 0 0 0.096 0.01 0.0
Fe2 Fe 0.5 0 0.5 0.84 0.0
Co4 Co 0.168 0.832 0.489 0.14 0.0
Nd1 Nd 0 0 0.343 1 0.0
Fe1 Fe 0 0 0.096 0.99 0.0
Co3 Co 0.285 0 0 0.06 0.0
