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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/1/53/39/1533983.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_1533983
loop_
_publ_author_name
'Kavecansky, V.'
'Rogl, P.'
'Mihalik, M.'
'Noel, H.'
'Wochowski, K.'
'Troc, R.'
_publ_section_title
;
 X-ray investigation of alloys with composition Th37.5 M25 M'37.5; M= Al,
 Ga, M' = Si, Ge
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              173
_journal_page_last               177
_journal_volume                  365
_journal_year                    2004
_chemical_formula_sum            'Al0.6942 Si1.0858 Th'
_chemical_name_systematic        'Th (Al0.39 Si0.61)1.78'
_space_group_IT_number           141
_symmetry_space_group_name_Hall  '-I 4bd 2'
_symmetry_space_group_name_H-M   'I 41/a m d :2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.17118
_cell_length_b                   4.17118
_cell_length_c                   14.3485
_cell_volume                     249.646
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Kavecansky_JALCEU_2004_1373.cif
_cod_data_source_block           Al0.6942Si1.0858Th1
_cod_original_cell_volume        249.6458
_cod_original_formula_sum        'Al0.6942 Si1.0858 Th1'
_cod_database_code               1533983
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/4,x+3/4,z+1/4
-x+1/2,-y,z+1/2
y+1/4,-x+1/4,z+3/4
x,-y,-z
y+1/4,x+3/4,-z+1/4
-x+1/2,y,-z+1/2
-y+1/4,-x+1/4,-z+3/4
-x,-y,-z
y-1/4,-x-3/4,-z-1/4
x-1/2,y,-z-1/2
-y-1/4,x-1/4,-z-3/4
-x,y,z
-y-1/4,-x-3/4,z-1/4
x-1/2,-y,z-1/2
y-1/4,x-1/4,z-3/4
x+1/2,y+1/2,z+1/2
-y+3/4,x+5/4,z+3/4
-x+1,-y+1/2,z+1
y+3/4,-x+3/4,z+5/4
x+1/2,-y+1/2,-z+1/2
y+3/4,x+5/4,-z+3/4
-x+1,y+1/2,-z+1
-y+3/4,-x+3/4,-z+5/4
-x+1/2,-y+1/2,-z+1/2
y+1/4,-x-1/4,-z+1/4
x,y+1/2,-z
-y+1/4,x+1/4,-z-1/4
-x+1/2,y+1/2,z+1/2
-y+1/4,-x-1/4,z+1/4
x,-y+1/2,z
y+1/4,x+1/4,z-1/4
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
Si1 Si 0 0.25 0.2893 0.54 0.0
Al1 Al 0 0.25 0.2893 0.35 0.0
Th1 Th 0 0.75 0.125 1 0.0
