#------------------------------------------------------------------------------
#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9007437.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_9007437
_chemical_name 'Antimonselite'
loop_
_publ_author_name
'Tideswell N W'
'Kruse F H'
'McCullough J D'
_journal_name_full "Acta Crystallographica"
_journal_volume 10
_journal_year 1957
_journal_page_first 99
_journal_page_last 102
_publ_section_title
;
 The crystal structure of antimony selenide, Sb2Se3
 Locality: synthetic
;
_chemical_formula_sum 'Sb2 Se3'
_cell_length_a 11.62
_cell_length_b 11.77
_cell_length_c 3.962
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 541.872
_symmetry_space_group_name_H-M 'P b n m'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'x,y,1/2-z'
  '-x,-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,z'
  '1/2+x,1/2-y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_Uiso_or_equiv
Sb1   0.32800   0.03050   0.25000   0.01393
Sb2   0.03970   0.14780   0.75000   0.01393
Se1   0.87320   0.05340   0.25000   0.01393
Se2   0.44340   0.13020   0.75000   0.01393
Se3   0.19350   0.21320   0.25000   0.01393