#------------------------------------------------------------------------------
#$Date: 2016-02-13 20:28:24 +0100 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://saulius.grazulis.lt/cod-secondary/cif/1/53/66/1536671.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_1536671
loop_
_publ_author_name
'Kissel, J.'
'Hoppe, R.'
_publ_section_title
;
 Ueber "Lithovanadate": Zur Kenntnis von Cs2 (Li V O4)und Cs2 (Li V O4)
;
_journal_name_full
'Zeitschrift fuer Anorganische und Allgemeine Chemie'
_journal_page_first              113
_journal_page_last               126
_journal_volume                  571
_journal_year                    1989
_chemical_formula_sum            'Cs2 Li O4 V'
_chemical_name_systematic        'Cs2 (Li V O4)'
_space_group_IT_number           36
_symmetry_space_group_name_Hall  'C 2c -2'
_symmetry_space_group_name_H-M   'C m c 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   6.105
_cell_length_b                   12.226
_cell_length_c                   8.155
_cell_volume                     608.687
_citation_journal_id_ASTM        ZAACAB
_cod_data_source_file            Kissel_ZAACAB_1989_1874.cif
_cod_data_source_block           Cs2Li1O4V1
_cod_original_formula_sum        'Cs2 Li1 O4 V1'
_cod_database_code               1536671
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,-y,z+1/2
-x,y,z
x,-y,z+1/2
x+1/2,y+1/2,z
-x+1/2,-y+1/2,z+1/2
-x+1/2,y+1/2,z
x+1/2,-y+1/2,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
Cs1 Cs+1 0 0.3936 0.9511 1 0.0
O2 O-2 0 0.3626 0.5868 1 0.0
O3 O-2 0.7639 0.3385 0.2882 1 0.0
Li1 Li+1 0 0.8011 0.1809 1 0.0
Cs2 Cs+1 0 0.9317 0.5926 1 0.0
O1 O-2 0 0.1617 0.4391 1 0.0
V1 V+5 0 0.302 0.3941 1 0.0
