#------------------------------------------------------------------------------
#$Date: 2009-05-13 21:45:18 +0300 (Wed, 13 May 2009) $
#$Revision: 720 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/1008451.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_1008451
_chemical_name_systematic          'Telluric acid bis(caesium chloride)'
_chemical_formula_structural       'Te (O H)6 (Cs Cl)2'
_chemical_formula_sum              'H6 Cl2 Cs2 O6 Te'
_publ_section_title
;
Crystal structure of a new telluric acid adduct : Te(OH)~6~ 2CsCl
;
loop_
_publ_author_name                  'Averbuch-Pouchot, M T'
_journal_name_full
;
Zeitschrift fuer Kristallographie (149,1979-)
;
_journal_coden_ASTM                ZEKRDZ
_journal_volume                    182
_journal_year                      1988
_journal_page_first                291
_journal_page_last                 295
_cell_length_a                     6.243(1)
_cell_length_b                     11.154(3)
_cell_length_c                     7.862(2)
_cell_angle_alpha                  90
_cell_angle_beta                   107.48(2)
_cell_angle_gamma                  90
_cell_volume                       522.2
_cell_formula_units_Z              2
_symmetry_space_group_name_H-M     'P 1 21/c 1'
_symmetry_Int_Tables_number        14
_symmetry_cell_setting             monoclinic
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '-x,1/2+y,1/2-z'
  '-x,-y,-z'
  'x,1/2-y,1/2+z'
loop_
_atom_type_symbol
_atom_type_oxidation_number
  Cs1+   1.000
  Te6+   6.000
  Cl1-  -1.000
  O2-   -2.000
  H1+    1.000
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
  Cs1   Cs1+   4 e 0.75774(5) 0.12969(3) 0.44006(4) 1.  0 d
  Te1   Te6+   2 a 0. 0. 0. 1.  0 d
  Cl1   Cl1-   4 e 0.3780(2) 0.3300(1) 0.1833(1) 1.  0 d
  O1    O2-    4 e 0.7342(5) 0.4344(3) 0.5367(4) 1.  0 d
  O2    O2-    4 e 0.0155(5) 0.1394(3) 0.8638(4) 1.  0 d
  O3    O2-    4 e 0.1671(6) 0.4263(3) 0.7198(4) 1.  0 d
  H1    H1+    4 e 0.68(1) 0.077(7) 0.949(9) 1.  0 d
  H2    H1+    4 e 0.13(1) 0.149(7) 0.84(1) 1.  0 d
  H3    H1+    4 e 0.20(1) 0.355(6) 0.693(8) 1.  0 d
_refine_ls_R_factor_all            0.027