#------------------------------------------------------------------------------
#$Date: 2015-07-13 01:14:41 +0200 (lun 13 de jul de 2015) $
#$Revision: 148519 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/71/1527147.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_1527147
loop_
_publ_author_name
'Bither, T.A.'
'Young, H.S.'
'Donohue, P.C.'
_publ_section_title
;
 Palladium and Platinum Phosphochalcogenides - Synthesis and Properties
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              300
_journal_page_last               307
_journal_volume                  3
_journal_year                    1971
_chemical_formula_sum            'P2 Pd3 S8'
_chemical_name_systematic        'Pd3 (P S4)2'
_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            1
_cell_length_a                   6.836
_cell_length_b                   6.836
_cell_length_c                   7.239
_cell_volume                     292.963
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Bither_JSSCBI_1971_1975.cif
_cod_data_source_block           P2Pd3S8
_cod_original_cell_volume        292.9633
_cod_database_code               1527147
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
Pd1 Pd+2 0.5 0 0 1 0.0
S1 S-2 0.174 -0.174 0.177 1 0.0
P1 P+5 0.3333 0.6667 0.3 1 0.0
S2 S-2 0.3333 0.6667 0.58 1 0.0
