#------------------------------------------------------------------------------
#$Date: 2008-01-13 22:15:36 +0000 (Sun, 13 Jan 2008) $
#$Revision: 14 $
#$URL: svn://www.crystallography.net/cod/cif/2/2005339.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_2005339
_journal_name_full  'Acta Crystallography'
_journal_year       1996
_journal_volume  C52
_journal_page_first  2129
_journal_page_last  2132
_publ_section_title
;
Tricaesium Ditellurium Tetravanadium Chloride Tetradecaoxide
;
_chemical_formula_moiety  '(Cs Cl) Cs2 (Te V2 O7)2'
_chemical_formula_sum  'Cl Cs3 O14 Te2 V4'
_chemical_formula_weight  1117.124
_symmetry_cell_setting  'orthorhombic'
loop_
_symmetry_equiv_pos_as_xyz
 'x, y, z'
 '-x, -y, z'
 '-x+1/2, y+1/2, -z+1/2'
 'x+1/2, -y+1/2, -z+1/2'
 '-x, -y, -z'
 'x, y, -z'
 'x-1/2, -y-1/2, z-1/2'
 '-x-1/2, y-1/2, z-1/2'
_symmetry_space_group_name_H-M  'P n n m'
_cell_length_a  23.608(8)
_cell_length_b  6.825(9)
_cell_length_c  5.4908(13)
_cell_angle_alpha  90.00
_cell_angle_beta  90.00
_cell_angle_gamma  90.00
_cell_volume  884.7(13)
_cell_formula_units_Z  2
_exptl_crystal_density_diffrn  4.194
_cell_measurement_temperature  293(2)
loop_
_atom_site_label
_atom_site_occupancy
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
 Te 1 0.41639(2) 0.57398(4) 0.5000 0.01108(7)
 Cs1 1 0.0 0.5000 0.5000 0.01875(10)
 Cs2 1 0.27091(2) 0.84715(7) 0.0 0.02238(9)
 V1 1 0.36314(4) 0.37055(13) 0.0 0.01057(13)
 V2 1 0.38412(4) 0.06332(12) 0.5000 0.00936(12)
 Cl 1 0.5000 0.5000 0.0 0.0293(5)
 O1 1 0.2986(2) 0.3031(8) 0.0 0.0225(9)
 O2 1 0.39843(14) 0.2047(5) 0.2483(6) 0.0192(5)
 O3 1 0.3647(2) 0.5811(5) 0.2451(6) 0.0220(6)
 O4 1 0.4311(2) 0.8503(6) 0.5000 0.0177(7)
 O5 1 0.3181(2) 0.0005(8) 0.5000 0.0211(8)