#------------------------------------------------------------------------------
#$Date: 2016-02-14 16:26:36 +0200 (Sun, 14 Feb 2016) $
#$Revision: 176435 $
#$URL: svn://www.crystallography.net/cod/cif/1/00/81/1008119.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_1008119
loop_
_publ_author_name
'Muller, O'
'Roy, R'
_publ_section_title              'Two new ternary copper-platinum oxides'
_journal_coden_ASTM              JCOMAH
_journal_name_full               'Journal of the Less-Common Metals'
_journal_page_first              209
_journal_page_last               214
_journal_paper_doi               10.1016/0022-5088(69)90097-6
_journal_volume                  19
_journal_year                    1969
_chemical_formula_structural     'Cu.80 Pt.20 O'
_chemical_formula_sum            'Cu0.8 O Pt0.2'
_chemical_name_systematic        'Copper platinum(II) oxide (.8/.2/1)'
_space_group_IT_number           131
_symmetry_cell_setting           tetragonal
_symmetry_Int_Tables_number      131
_symmetry_space_group_name_Hall  '-P 4c 2'
_symmetry_space_group_name_H-M   'P 42/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   2.934
_cell_length_b                   2.934
_cell_length_c                   5.194
_cell_volume                     44.7
_refine_ls_R_factor_all          0.201
_cod_original_formula_sum        'Cu.8 O Pt.2'
_cod_database_code               1008119
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z
-y,x,1/2+z
y,-x,1/2+z
-x,y,-z
x,-y,-z
y,x,1/2-z
-y,-x,1/2-z
-x,-y,-z
x,y,-z
y,-x,1/2-z
-y,x,1/2-z
x,-y,z
-x,y,z
-y,-x,1/2+z
y,x,1/2+z
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
Cu1 Cu2+ 2 c 0. 0.5 0. 0.8 0 d
Pt1 Pt2+ 2 c 0. 0.5 0. 0.2 0 d
O1 O2- 2 e 0. 0. 0.25 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Cu2+ 2.000
Pt2+ 2.000
O2- -2.000
