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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/7/22/25/7222598.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_7222598
loop_
_publ_author_name
'Mishra, R.'
'Poettgen, R.'
'Mosel, B.D.'
'Hoffmann, R.D.'
'Trill, H.'
'Piotrowski, H.'
'Zumdick, M.F.'
_publ_section_title
;
 The stannides RE Rh Sn (RE= Ho-Yb) and Sc T Sn (T= Pd, Pt) - structure
 refinements and 119Sn Moessbauer spectroscopy
;
_journal_name_full
;
Zeitschrift fuer Naturforschung, Teil B. Anorganische Chemie, Organische 
Chemie (42,1987-)
;
_journal_page_first              589
_journal_page_last               597
_journal_volume                  56
_journal_year                    2001
_chemical_formula_sum            'Pt Sc Sn'
_chemical_name_systematic        'Sc Pt Sn'
_space_group_IT_number           190
_symmetry_space_group_name_Hall  'P -6c -2c'
_symmetry_space_group_name_H-M   'P -6 2 c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            6
_cell_length_a                   7.3837
_cell_length_b                   7.3837
_cell_length_c                   7.2947
_cell_volume                     344.418
_citation_journal_id_ASTM        ZNBSEN
_cod_data_source_file            Mishra_ZNBSEN_2001_186.cif
_cod_data_source_block           Pt1Sc1Sn1
_cod_original_cell_volume        344.4182
_cod_original_formula_sum        'Pt1 Sc1 Sn1'
_cod_database_code               7222598
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x+y,-x,-z+1/2
-y,x-y,z
x,y,-z+1/2
-x+y,-x,z
-y,x-y,-z+1/2
y,x,z+1/2
x-y,-y,-z
-x,-x+y,z+1/2
y,x,-z
x-y,-y,z+1/2
-x,-x+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
Sc1 Sc 0.4047 0.0191 0.25 1 0.0
Sn1 Sn 0.72699 0 0 1 0.0
Pt2 Pt 0 0 0.25 1 0.0
Pt1 Pt 0.3333 0.6667 0.03656 1 0.0
