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#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/12/1541264.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_1541264
loop_
_publ_author_name
'Moze, O.'
'Pareti, L.'
'David, W.I.F.'
'Solzi, M.'
'Marusi, G.'
_publ_section_title
;
 Preferential site occupation in Y and La substituted Pr2 Fe14 B
 intermetallic compounds
;
_journal_name_full               'Physik (Berlin)'
_journal_page_first              747
_journal_page_last               750
_journal_volume                  156
_journal_year                    1989
_chemical_formula_sum            'B Fe14 La0.2 Pr1.8'
_chemical_name_systematic        'Pr1.8 La.2 Fe14 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                   8.7852
_cell_length_b                   8.7852
_cell_length_c                   12.2418
_cell_volume                     944.819
_citation_journal_id_ASTM        PHYBE3
_cod_data_source_file            Moze_PHYBE3_1989_1032.cif
_cod_data_source_block           B1Fe14La0.2Pr1.8
_cod_original_formula_sum        'B1 Fe14 La0.2 Pr1.8'
_cod_database_code               1541264
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
La2 La 0.1461 -0.1461 0 0.13 0.0
Fe6 Fe 0 0.5 0 1 0.0
Pr1 Pr 0.2685 0.2685 0 0.93 0.0
Fe2 Fe 0.0357 0.3593 0.1779 1 0.0
La1 La 0.2685 0.2685 0 0.07 0.0
B1 B 0.3794 -0.3794 0 1 0.0
Fe3 Fe 0.0979 0.0979 0.2066 1 0.0
Fe1 Fe 0.2249 0.5674 0.1275 1 0.0
Fe4 Fe 0.319 0.319 0.2467 1 0.0
Fe5 Fe 0.5 0.5 0.11 1 0.0
Pr2 Pr 0.1461 -0.1461 0 0.87 0.0
