#------------------------------------------------------------------------------
#$Date: 2016-02-13 13:50:18 +0100 (Sat 13 de Feb de 2016) $
#$Revision: 176428 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/79/1527945.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_1527945
loop_
_publ_author_name
'Polyanskaya, T.M.'
'Borisov, S.V.'
'Belov, N.V.'
_publ_section_title
;
 The structure of Nd4 W3 O15
;
_journal_name_full               Kristallografiya
_journal_page_first              1135
_journal_page_last               1139
_journal_volume                  15
_journal_year                    1970
_chemical_formula_sum            'Nd4 O15 W3'
_chemical_name_systematic        'Nd4 W3 O15'
_space_group_IT_number           137
_symmetry_space_group_name_Hall  'P 4n 2n -1n'
_symmetry_space_group_name_H-M   'P 42/n m c :1'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            4
_cell_length_a                   9.92
_cell_length_b                   9.92
_cell_length_c                   12.5
_cell_volume                     1230.080
_citation_journal_id_ASTM        KRISAJ
_cod_data_source_file            Polyanskaya_KRISAJ_1970_1901.cif
_cod_data_source_block           Nd4O15W3
_cod_original_cell_volume        1230.08
_cod_original_sg_symbol_Hall     '-P 4ac 2a (x-1/4,y+1/4,z+1/4)'
_cod_database_code               1527945
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y+1/2,x+1/2,z+1/2
-x,-y,z
y+1/2,-x+1/2,z+1/2
x+1/2,-y+1/2,-z+1/2
y,x,-z
-x+1/2,y+1/2,-z+1/2
-y,-x,-z
-x+1/2,-y+1/2,-z+1/2
y,-x,-z
x+1/2,y+1/2,-z+1/2
-y,x,-z
-x,y,z
-y+1/2,-x+1/2,z+1/2
x,-y,z
y+1/2,x+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
Nd3 Nd+3 0 0.2691 0.233 0.75 0.0
O3 O-2 0 0.313 0.431 1 0.0
W1 W+6 0.5 0 0.0434 1 0.0
O6 O-2 0 0 0.238 1 0.0
O5 O-2 0 0.357 0.027 1 0.0
O1 O-2 0.162 0.128 0.114 1 0.0
O2 O-2 0.143 0.199 0.671 1 0.0
W2 W+6 0.1974 0 0.2261 1 0.0
Nd1 Nd+3 0 0 0 1 0.0
O4 O-2 0 0.384 0.819 1 0.0
Nd2 Nd+3 0.2775 0.2775 0 1 0.0
