#------------------------------------------------------------------------------
#$Date: 2015-07-14 00:49:53 +0200 (mar 14 de jul de 2015) $
#$Revision: 151420 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/87/1528766.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_1528766
loop_
_publ_author_name
'Obbade, S.'
'Renard, C.'
'Abraham, F.'
_publ_section_title
;
 New open-framework in the uranyl vanadates A3 (U O2)7 (V O4)5 O (A = Li,
 Ag) with intergrowth structure between A (U O2)4 (V O4)3 and A2 (U O2)3
 (V O4)2 O
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              413
_journal_page_last               420
_journal_volume                  182
_journal_year                    2009
_chemical_formula_sum            'Li3 O35 U7 V5'
_chemical_name_systematic        'Li3 (U O2)7 (V O4)5 O'
_space_group_IT_number           115
_symmetry_space_group_name_Hall  'P -4 -2'
_symmetry_space_group_name_H-M   'P -4 m 2'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            1
_cell_length_a                   7.2794
_cell_length_b                   7.2794
_cell_length_c                   14.514
_cell_volume                     769.092
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Obbade_JSSCBI_2009_1706.cif
_cod_data_source_block           Li3O35U7V5
_cod_database_code               1528766
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
y,-x,-z
-x,-y,z
-y,x,-z
-x,y,z
y,x,-z
x,-y,z
-y,-x,-z
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
V3 V+5 0.5 0.5 0.5 1 0.0
O1 O-2 0 0 0 1 0.0
U3 U+6 0 0 0.14504 1 0.0
V2 V+5 0.5 0 0.9471 1 0.0
U4 U+6 0.5 0 0.72515 1 0.0
O10 O-2 0.5 0.761 0.7242 1 0.0
Li2 Li+1 0.5 0 0.161 0.75 0.0
O5 O-2 0.325 0 0.871 1 0.0
O8 O-2 0.694 0.5 0.5673 1 0.0
O2 O-2 0.8 0 0.4328 1 0.0
V1 V+5 0 0 0.3711 1 0.0
O4 O-2 0.5 0.5 0.875 1 0.0
U2 U+6 0.5 0 0.43218 1 0.0
O6 O-2 0.5 0 0.3084 1 0.0
O11 O-2 0.754 0 0.1497 1 0.0
U1 U+6 0.5 0.5 0 1 0.0
O7 O-2 0 0.82 0.2944 1 0.0
Li1 Li+1 0.5 0.5 0.711 0.75 0.0
O9 O-2 0.5 0 0.5603 1 0.0
O3 O-2 0.5 0.814 0.0159 1 0.0
