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#$Date: 2010-01-30 15:59:17 +0200 (Sat, 30 Jan 2010) $
#$Revision: 966 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/1008965.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_1008965
_chemical_name_systematic          'Platinum oxide (3/4)'
_chemical_formula_structural       'Pt3 O4'
_chemical_formula_sum              'O4 Pt3'
_publ_section_title
;
Formation and stability of the platinum and rhodium oxides at high
oxygen pressures and the structures of Pt3 O4, $-beta-Pt O2 and Rh
O2
;
loop_
_publ_author_name
  'Muller, O'
  'Roy, R'
_journal_name_full                 'Journal of the Less-Common Metals'
_journal_coden_ASTM                JCOMAH
_journal_volume                    16
_journal_year                      1968
_journal_page_first                129
_journal_page_last                 146
_cell_length_a                     5.585
_cell_length_b                     5.585
_cell_length_c                     5.585
_cell_angle_alpha                  90
_cell_angle_beta                   90
_cell_angle_gamma                  90
_cell_volume                       174.2
_cell_formula_units_Z              2
_symmetry_space_group_name_H-M     'P m -3 n'
_symmetry_Int_Tables_number        223
_symmetry_cell_setting             cubic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'y,z,x'
  'z,x,y'
  '-x,-y,-z'
  '-y,-z,-x'
  '-z,-x,-y'
  'x,-y,-z'
  'y,-z,-x'
  'z,-x,-y'
  '-x,y,z'
  '-y,z,x'
  '-z,x,y'
  '-x,y,-z'
  '-y,z,-x'
  '-z,x,-y'
  'x,-y,z'
  'y,-z,x'
  'z,-x,y'
  '-x,-y,z'
  '-y,-z,x'
  '-z,-x,y'
  'x,y,-z'
  'y,z,-x'
  'z,x,-y'
  '1/2+x,1/2+z,1/2+y'
  '1/2+y,1/2+x,1/2+z'
  '1/2+z,1/2+y,1/2+x'
  '1/2-x,1/2-z,1/2-y'
  '1/2-y,1/2-x,1/2-z'
  '1/2-z,1/2-y,1/2-x'
  '1/2+x,1/2-z,1/2-y'
  '1/2+y,1/2-x,1/2-z'
  '1/2+z,1/2-y,1/2-x'
  '1/2-x,1/2+z,1/2+y'
  '1/2-y,1/2+x,1/2+z'
  '1/2-z,1/2+y,1/2+x'
  '1/2-x,1/2-z,1/2+y'
  '1/2-y,1/2-x,1/2+z'
  '1/2-z,1/2-y,1/2+x'
  '1/2+x,1/2+z,1/2-y'
  '1/2+y,1/2+x,1/2-z'
  '1/2+z,1/2+y,1/2-x'
  '1/2-x,1/2+z,1/2-y'
  '1/2-y,1/2+x,1/2-z'
  '1/2-z,1/2+y,1/2-x'
  '1/2+x,1/2-z,1/2+y'
  '1/2+y,1/2-x,1/2+z'
  '1/2+z,1/2-y,1/2+x'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Pt3+   2.670
  O2-   -2.000
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
  Pt1   Pt3+   6 c 0.25 0. 0.5 1.  0 d
  O1    O2-    8 e 0.25 0.25 0.25 1.  0 d
_refine_ls_R_factor_all            0.152
_cod_database_code 1008965