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#$Date: 2016-02-13 13:50:18 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/2/10/73/2107391.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided by IUCr Journals, http://journals.iucr.org/.
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_2107391
loop_
_publ_author_name
'Ben Amara, M.'
'Vlasse, M.'
'Olazcuaga, R.'
'le Flem, G.'
_publ_section_title
;
 The Crystal Structure of Cadmium Sodium Orthovanadate Cd4 Na (V O4)3
;
_journal_name_full               'Acta Crystallographica B (24,1968-38,1982)'
_journal_page_first              50
_journal_page_last               52
_journal_volume                  35
_journal_year                    1979
_chemical_formula_sum            'Cd1.3332 Na0.3333 O3.9996 V0.9999'
_chemical_name_systematic        '(Cd4 Na (V O4)3).3333'
_space_group_IT_number           33
_symmetry_space_group_name_Hall  'P -2ac -2n'
_symmetry_space_group_name_H-M   'P n 21 a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.82
_cell_length_b                   7.04
_cell_length_c                   5.36
_cell_volume                     370.552
_citation_journal_id_ASTM        ACBCAR
_cod_data_source_file            BenAmara_ACBCAR_1979_1751.cif
_cod_data_source_block           Cd1.3332Na0.3333O3.9996V0.9999
_cod_original_cell_volume        370.5518
_cod_original_sg_symbol_Hall     'P 2c -2n (-x,z,y)'
_cod_database_code               2107391
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y+1/2,-z
-x+1/2,y+1/2,z+1/2
x+1/2,y,-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
Cd2 Cd+2 0.0012 0.02 0.0009 1 0.0
O3 O-2 0.3584 0.2748 0.4413 1 0.0
Na1 Na+1 0.3539 0.2713 0.9957 0.3333 0.0
O4 O-2 0.1308 0.2726 0.8022 1 0.0
O1 O-2 0.1152 0.0884 0.3344 1 0.0
V1 V+5 0.1809 0.2679 0.4928 1 0.0
O2 O-2 0.1189 0.4705 0.3575 1 0.0
Cd1 Cd+2 0.3539 0.2713 0.9957 0.3333 0.0
