#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/2/10/72/2107204.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2107204
loop_
_publ_author_name
'Sinha, A.K.'
_publ_section_title
;
 The crystal structure of Ti (Pt.89 Ni.11)3
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              996
_journal_page_last               997
_journal_volume                  25
_journal_year                    1969
_chemical_formula_sum            'Pt3 Ti'
_space_group_IT_number           164
_symmetry_space_group_name_Hall  '-P 3 2"'
_symmetry_space_group_name_H-M   'P -3 m 1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            7
_cell_length_a                   5.491
_cell_length_b                   5.491
_cell_length_c                   15.67
_cell_volume                     409.169
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            Sinha_ACBCAR_1969_1545.cif
_cod_data_source_block           Pt3Ti1
_cod_original_cell_volume        409.1688
_cod_original_formula_sum        'Pt3 Ti1'
_cod_database_code               2107204
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
-x+y,-x,z
y,x,-z
-x,-x+y,-z
x-y,-y,-z
-x,-y,-z
y,-x+y,-z
x-y,x,-z
-y,-x,z
x,x-y,z
-x+y,y,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
Pt4 Pt 0.167 0.833 0.857 1 0.0
Ti4 Ti 0.3333 0.66666 0.571 1 0.0
Ti1 Ti 0 0 0 1 0.0
Ti3 Ti 0.3333 0.66666 0.143 1 0.0
Pt1 Pt 0.5 0 0 1 0.0
Pt3 Pt 0.167 0.833 0.429 1 0.0
Pt2 Pt 0.5 0.5 0.286 1 0.0
Ti2 Ti 0 0 0.286 1 0.0
