#------------------------------------------------------------------------------
#$Date: 2015-07-12 18:44:21 +0200 (dom 12 de jul de 2015) $
#$Revision: 147571 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/63/1526394.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_1526394
loop_
_publ_author_name
'Huang, F.Q.'
'Ibers, J.A.'
_publ_section_title
;
 Syntheses and structures of the quaternary copper tellurides K2 Ln4 Cu5
 Te10 (Ln = Sm, Gd, Er), Rb3 Ln4 Cu5 Te10 (Ln = Nd, Gd) and Cs3 Gd4 Cu5
 Te10
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              409
_journal_page_last               414
_journal_volume                  160
_journal_year                    2001
_chemical_formula_sum            'Cu5 Nd4 Rb3 Te10'
_chemical_name_systematic        'Rb3 Nd4 Cu5 Te10'
_space_group_IT_number           58
_symmetry_space_group_name_Hall  '-P 2 2n'
_symmetry_space_group_name_H-M   'P n n m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   17.356
_cell_length_b                   17.82
_cell_length_c                   4.3811
_cell_volume                     1355.004
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Huang_JSSCBI_2001_1646.cif
_cod_data_source_block           Cu5Nd4Rb3Te10
_cod_database_code               1526394
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
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
Te5 Te-2 0.3237 0.5013 0 1 0.0
Te2 Te-2 0.22116 0.21168 0 1 0.0
Te3 Te-2 0.62407 0.10199 0 1 0.0
Te4 Te-2 0.50238 0.32579 0 1 0.0
Cu3 Cu+1 0.4788 0.0587 0 0.5 0.0
Nd2 Nd+3 0.2876 0.05428 0 1 0.0
Rb1 Rb+1 0.82925 0.1705 0 1 0.0
Nd1 Nd+3 0.06178 0.27914 0 1 0.0
Rb2 Rb+1 0 0 0 1 0.0
Te1 Te-2 0.08611 0.60707 0 1 0.0
Cu1 Cu+1 0.34512 0.64932 0 1 0.0
Cu2 Cu+1 0.06182 0.46097 0 1 0.0
