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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/1/53/38/1533849.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_1533849
loop_
_publ_author_name
'Vennstrom, M.'
'Grechnev, A.'
'Eriksson, O.'
'Andersson, Y.'
_publ_section_title
;
 Phase relations in the (Ti3 Sn) - D system
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              127
_journal_page_last               131
_journal_volume                  364
_journal_year                    2004
_chemical_formula_sum            'D0.8 Sn Ti3'
_chemical_name_systematic        'Ti3 Sn D0.8'
_space_group_IT_number           20
_symmetry_space_group_name_Hall  'C 2c 2'
_symmetry_space_group_name_H-M   'C 2 2 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.179
_cell_length_b                   9.877
_cell_length_c                   4.7898
_cell_volume                     292.321
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Vennstrom_JALCEU_2004_1352.cif
_cod_data_source_block           D0.8Sn1Ti3
_cod_original_cell_volume        292.3214
_cod_original_formula_sum        'D0.8 Sn1 Ti3'
_cod_database_code               1533849
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
x,-y,-z
-x,y,-z+1/2
x+1/2,y+1/2,z
-x+1/2,-y+1/2,z+1/2
x+1/2,-y+1/2,-z
-x+1/2,y+1/2,-z+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
Ti2 Ti 0 0.8554 0.25 1 0.0
D1 D 0.052 0 0 0.804 0.0
Sn1 Sn 0 0.3326 0.25 1 0.0
Ti1 Ti 0.2656 0.095 0.252 1 0.0
