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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/25/1532595.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_1532595
loop_
_publ_author_name
'Isnard, O.'
'Long, G.J.'
'Grandjean, F.'
'Buschow, K.H.J.'
'Hautot, D.'
_publ_section_title
;
 A neutron diffraction and Mossbauer spectral study of the magnetic spin
 reorientation in Nd6 Fe13 Si
;
_journal_name_full               'Journal of Physics: Condensed Matter'
_journal_page_first              12391
_journal_page_last               12409
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'Fe13 Nd6 Si'
_chemical_name_systematic        'Nd6 Fe13 Si'
_space_group_IT_number           140
_symmetry_space_group_name_Hall  '-I 4 2c'
_symmetry_space_group_name_H-M   'I 4/m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.0452
_cell_length_b                   8.0452
_cell_length_c                   22.772
_cell_volume                     1473.923
_citation_journal_id_ASTM        JCOMEL
_cod_data_source_file            Isnard_JCOMEL_2002_739.cif
_cod_data_source_block           Fe13Nd6Si1
_cod_original_formula_sum        'Fe13 Nd6 Si1'
_cod_database_code               1532595
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x,z
-x,-y,z
y,-x,z
x,-y,-z+1/2
y,x,-z+1/2
-x,y,-z+1/2
-y,-x,-z+1/2
-x,-y,-z
y,-x,-z
x,y,-z
-y,x,-z
-x,y,z-1/2
-y,-x,z-1/2
x,-y,z-1/2
y,x,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
y+1/2,x+1/2,-z+1
-x+1/2,y+1/2,-z+1
-y+1/2,-x+1/2,-z+1
-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
-y+1/2,-x+1/2,z
x+1/2,-y+1/2,z
y+1/2,x+1/2,z
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
Fe2 Fe 0.1783 0.6783 0.0614 1 0.0
Nd1 Nd 0 0 0.1115 1 0.0
Fe3 Fe 0.3876 0.8876 0.0974 1 0.0
Nd2 Nd 0.1663 0.6663 0.1903 1 0.0
Fe1 Fe 0.0673 0.2082 0 1 0.0
Si1 Si 0 0 0.25 1 0.0
Fe4 Fe 0 0.5 0 1 0.0
