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#$Date: 2015-07-10 12:56:45 +0300 (Fri, 10 Jul 2015) $
#$Revision: 141684 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/14/1521473.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_1521473
loop_
_publ_author_name
'Kuz'ma, Yu.B.'
'Chikhrii, S.I.'
'Davydov, V.N.'
_publ_section_title
;
 Refined crystal structure of Sn4 P3
;
_journal_name_full               'Neorganicheskie Materialy'
_journal_page_first              17
_journal_page_last               18
_journal_volume                  35
_journal_year                    1999
_chemical_formula_sum            'P2.92 Sn4.008'
_chemical_name_systematic        'Sn4.008 P2.92'
_space_group_IT_number           166
_symmetry_space_group_name_Hall  '-R 3 2"'
_symmetry_space_group_name_H-M   'R -3 m :H'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            3
_cell_length_a                   3.963
_cell_length_b                   3.963
_cell_length_c                   35.3
_cell_volume                     480.124
_citation_journal_id_ASTM        NMATEI
_cod_data_source_file            Kuzma_NMATEI_1999_557.cif
_cod_data_source_block           P2.92Sn4.008
_cod_original_cell_volume        480.1241
_cod_database_code               1521473
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
x+2/3,y+1/3,z+1/3
-y+2/3,x-y+1/3,z+1/3
-x+y+2/3,-x+1/3,z+1/3
y+2/3,x+1/3,-z+1/3
-x+2/3,-x+y+1/3,-z+1/3
x-y+2/3,-y+1/3,-z+1/3
-x+2/3,-y+1/3,-z+1/3
y+2/3,-x+y+1/3,-z+1/3
x-y+2/3,x+1/3,-z+1/3
-y+2/3,-x+1/3,z+1/3
x+2/3,x-y+1/3,z+1/3
-x+y+2/3,y+1/3,z+1/3
x+1/3,y+2/3,z+2/3
-y+1/3,x-y+2/3,z+2/3
-x+y+1/3,-x+2/3,z+2/3
y+1/3,x+2/3,-z+2/3
-x+1/3,-x+y+2/3,-z+2/3
x-y+1/3,-y+2/3,-z+2/3
-x+1/3,-y+2/3,-z+2/3
y+1/3,-x+y+2/3,-z+2/3
x-y+1/3,x+2/3,-z+2/3
-y+1/3,-x+2/3,z+2/3
x+1/3,x-y+2/3,z+2/3
-x+y+1/3,y+2/3,z+2/3
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
P2 P 0 0 0 0.98 0.0
Sn2 Sn 0 0 0.28942 0.997 0.0
P1 P 0 0 0.429 0.97 0.0
Sn1 Sn 0 0 0.13405 1.007 0.0
