#------------------------------------------------------------------------------
#$Date: 2015-01-27 21:58:39 +0200 (Tue, 27 Jan 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/1/01/11/1011183.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_1011183
loop_
_publ_author_name
'Ito, T'
'Sawada, H'
_publ_section_title              'The crystal structure of tellurite (Te O2)'
_journal_coden_ASTM              ZEKGAX
_journal_name_full
;
Zeitschrift fuer Kristallographie, Kristallgeometrie, Kristallphysik,
Kristallchemie (-144,1977)
;
_journal_page_first              13
_journal_page_last               25
_journal_volume                  102
_journal_year                    1940
_chemical_compound_source
;
from Rendaizi mine, Izu Peninsula, Shizuoka Prefecture
;
_chemical_formula_structural     'Te O2'
_chemical_formula_sum            'O2 Te'
_chemical_name_mineral           Tellurite
_chemical_name_systematic        'Tellurium oxide'
_space_group_IT_number           61
_symmetry_cell_setting           orthorhombic
_symmetry_Int_Tables_number      61
_symmetry_space_group_name_Hall  '-P 2bc 2ac'
_symmetry_space_group_name_H-M   'P c a b'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            8
_cell_length_a                   5.5
_cell_length_b                   11.75
_cell_length_c                   5.59
_cell_volume                     361.3
_exptl_crystal_density_meas      4.9
_cod_database_code               1011183
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2+x,-y,1/2-z
-x,1/2-y,1/2+z
1/2-x,1/2+y,-z
-x,-y,-z
1/2-x,y,1/2+z
x,1/2+y,1/2-z
1/2+x,1/2-y,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
Te1 Te4+ 8 c 0.0275 0.1183 -0.1156 1. 0 d
O1 O2- 8 c 0.24 -0.022 0.235 1. 0 d
O2 O2- 8 c 0.164 0.174 0.535 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Te4+ 4.000
O2- -2.000
