#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/53/75/1537586.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_1537586
loop_
_publ_author_name
'Lindqvist, O.'
_publ_section_title
;
 Refinement of the structure of alpha-Te O2
;
_journal_name_full
'Acta Chemica Scandinavica (1-27,1973-42,1988)'
_journal_page_first              977
_journal_page_last               982
_journal_volume                  22
_journal_year                    1968
_chemical_formula_sum            'O2 Te'
_chemical_name_systematic        'Te O2'
_space_group_IT_number           92
_symmetry_space_group_name_Hall  'P 4abw 2nw'
_symmetry_space_group_name_H-M   'P 41 21 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   4.8122
_cell_length_b                   4.8122
_cell_length_c                   7.6157
_cell_volume                     176.359
_citation_journal_id_ASTM        ACSAA4
_cod_data_source_file            Lindqvist_ACSAA4_1968_1933.cif
_cod_data_source_block           O2Te1
_cod_original_cell_volume        176.3588
_cod_original_formula_sum        'O2 Te1'
_cod_database_code               1537586
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x+1/2,z+1/4
-x,-y,z+1/2
y+1/2,-x+1/2,z+3/4
x+1/2,-y+1/2,-z+3/4
y,x,-z
-x+1/2,y+1/2,-z+1/4
-y,-x,-z+1/2
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
Te1 Te+4 0.0279 0.0279 0 1 0.0
O1 O-2 0.145 0.262 0.187 1 0.0
