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#$Date: 2016-01-03 11:47:12 +0200 (Sun, 03 Jan 2016) $
#$Revision: 172575 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/12/1541284.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_1541284
loop_
_publ_author_name
'Murray, J.R.'
_publ_section_title
;
 The constitution of thorium-zirconium alloys containing more than 15
 percent zirconium and the effect of some third elements on the stability
 of the body-centred-cubic phase in these alloys
;
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              1
_journal_page_last               10
_journal_volume                  2
_journal_year                    1960
_chemical_formula_sum            'Th0.5 Zr1.5'
_chemical_name_systematic        '(Th Zr3)0.5'
_space_group_IT_number           229
_symmetry_space_group_name_Hall  '-I 4 2 3'
_symmetry_space_group_name_H-M   'I m -3 m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   3.71
_cell_length_b                   3.71
_cell_length_c                   3.71
_cell_volume                     51.065
_citation_journal_id_ASTM        JCOMAH
_cod_data_source_file            Murray_JCOMAH_1960_165.cif
_cod_data_source_block           Th0.5Zr1.5
_cod_original_cell_volume        51.06481
_cod_database_code               1541284
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
z,x,y
-x,z,y
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z,-x,-y
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z,y,-x
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y,x,z
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x,-z,-y
z,x,-y
-x,z,-y
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z,-x,y
x,z,y
-y,-z,-x
-y,z,x
-z,-y,x
y,-z,x
z,y,x
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y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
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z+1/2,x+1/2,y+1/2
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x+1/2,-z+1/2,y+1/2
z+1/2,-x+1/2,-y+1/2
x+1/2,z+1/2,-y+1/2
-z+1/2,x+1/2,-y+1/2
-x+1/2,-z+1/2,-y+1/2
y+1/2,z+1/2,x+1/2
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z+1/2,x+1/2,-y+1/2
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z+1/2,-x+1/2,y+1/2
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-y+1/2,-z+1/2,-x+1/2
-y+1/2,z+1/2,x+1/2
-z+1/2,-y+1/2,x+1/2
y+1/2,-z+1/2,x+1/2
z+1/2,y+1/2,x+1/2
y+1/2,z+1/2,-x+1/2
-z+1/2,y+1/2,-x+1/2
z+1/2,-y+1/2,-x+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
Zr1 Zr 0 0 0 0.75 0.0
Th1 Th 0 0 0 0.25 0.0
