#------------------------------------------------------------------------------
#$Date: 2016-02-18 16:37:37 +0100 (jue 18 de feb de 2016) $
#$Revision: 176729 $
#$URL: svn://www.crystallography.net/cod/cif/1/01/12/1011292.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_1011292
loop_
_publ_author_name
'Spiegelberg, P'
_publ_section_title              'X-ray studies on potassium antimonates'
_journal_coden_ASTM              ARKGAJ
_journal_name_full               'Arkiv foer Kemi, Mineralogi och Geologi, A'
_journal_page_first              1
_journal_page_last               12
_journal_volume                  14
_journal_year                    1940
_chemical_formula_structural     'K (Sb O3)'
_chemical_formula_sum            'K O3 Sb'
_chemical_name_systematic        'Potassium catena-antimonate'
_space_group_IT_number           201
_symmetry_cell_setting           cubic
_symmetry_space_group_name_Hall  'P 2 2 3 -1n'
_symmetry_space_group_name_H-M   'P n -3 :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            12
_cell_length_a                   9.6
_cell_length_b                   9.6
_cell_length_c                   9.6
_cell_volume                     884.7
_exptl_crystal_density_meas      4.7
_cod_original_sg_symbol_H-M      'P n -3 S'
_cod_database_code               1011292
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x,-y,-z
-x,y,-z
-x,-y,z
y,z,x
-y,-z,x
y,-z,-x
-y,z,-x
z,x,y
-z,x,-y
-z,-x,y
z,-x,-y
1/2-x,1/2-y,1/2-z
1/2-x,1/2+y,1/2+z
1/2+x,1/2-y,1/2+z
1/2+x,1/2+y,1/2-z
1/2-y,1/2-z,1/2-x
1/2+y,1/2+z,1/2-x
1/2-y,1/2+z,1/2+x
1/2+y,1/2-z,1/2+x
1/2-z,1/2-x,1/2-y
1/2+z,1/2-x,1/2+y
1/2+z,1/2+x,1/2-y
1/2-z,1/2+x,1/2+y
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
K1 K1+ 4 c 0.75 0.75 0.75 1. 0 d
K2 K1+ 8 e 0.139 0.139 0.139 1. 0 d
Sb1 Sb5+ 12 g 0.34(7) 0.5 0. 1. 0 d
O1 O2- 12 f 0.36(1) 0. 0. 1. 0 d
O2 O2- 24 h 0.28(9) 0. 0.347 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
K1+ 1.000
Sb5+ 5.000
O2- -2.000
