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#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/1/51/10/1511078.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_1511078
loop_
_publ_author_name
'Hewat, A.W.'
'Moze, O.'
'Pareti, L.'
'Harrison, W.T.A.'
'David, W.I.F.'
'Solzi, M.'
'Bolzoni, F.'
_publ_section_title
;
 Magnetic structure and preferential site occupation in manganese- and
 chromium-substituted Y2Fe14B
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              375
_journal_page_last               383
_journal_paper_doi               10.1016/0022-5088(88)90440-7
_journal_volume                  136
_journal_year                    1988
_chemical_formula_sum            'B Cr1.118 Fe12.943 Y2'
_chemical_name_systematic        'Y2 Fe12.943 Cr1.118 B'
_space_group_IT_number           136
_symmetry_space_group_name_Hall  '-P 4n 2n'
_symmetry_space_group_name_H-M   'P 42/m n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   8.7284
_cell_length_b                   8.7284
_cell_length_c                   11.9915
_cell_volume                     913.572
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            boron0-1_173.cif
_cod_data_source_block           B1Cr1.118Fe12.943Y2
_cod_original_cell_volume        913.5721
_cod_original_formula_sum        'B1 Cr1.118 Fe12.943 Y2'
_cod_database_code               1511078
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x+1/2,z+1/2
-x,-y,z
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y,x,-z
-x+1/2,y+1/2,-z+1/2
-y,-x,-z
-x,-y,-z
y-1/2,-x-1/2,-z-1/2
x,y,-z
-y-1/2,x-1/2,-z-1/2
-x-1/2,y-1/2,z-1/2
-y,-x,z
x-1/2,-y-1/2,z-1/2
y,x,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
Fe1 Fe 0.5 0.5 0.1164 1.043 0.0
Fe2 Fe 0 0.5 0 1.018 0.0
Fe3 Fe 0.0974 0.0974 0.2015 0.886 0.0
Cr2 Cr 0.3187 0.3187 0.2442 0.157 0.0
Fe4 Fe 0.3187 0.3187 0.2442 0.843 0.0
Cr4 Cr 0.0366 0.3599 0.1706 0.068 0.0
Cr1 Cr 0.0974 0.0974 0.2015 0.114 0.0
Fe5 Fe 0.2181 0.5686 0.1256 0.924 0.0
Y1 Y 0.2676 0.2676 0 1 0.0
Fe6 Fe 0.0366 0.3599 0.1706 0.932 0.0
Cr3 Cr 0.2181 0.5686 0.1256 0.076 0.0
B1 B 0.3767 0.6233 0 1 0.0
Y2 Y 0.1491 0.8509 0 1 0.0
