#------------------------------------------------------------------------------
#$Date: 2018-09-27 07:13:35 +0300 (Thu, 27 Sep 2018) $
#$Revision: 211196 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/52/69/1526921.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_1526921
loop_
_publ_author_name
'Wang, M.'
'Mar, A.'
_publ_section_title
;
 Nb28 Ni33.5 Sb12.5, a new representative of the X-phase
;
_journal_name_full               'Journal of Solid State Chemistry'
_journal_page_first              450
_journal_page_last               459
_journal_volume                  160
_journal_year                    2001
_chemical_formula_sum            'Nb28 Ni33.56 Sb12.44'
_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            1
_cell_length_a                   13.2334
_cell_length_b                   16.5065
_cell_length_c                   5.0337
_cell_volume                     1099.547
_citation_journal_id_ASTM        JSSCBI
_cod_data_source_file            Wang_JSSCBI_2001_1653.cif
_cod_data_source_block           Nb28Ni33.56Sb12.44
_cod_database_code               1526921
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
Sb1 Sb 0.5037 0.28599 0 1 0.0
Sb2 Sb 0 0 0 1 0.0
Nb7 Nb 0.59926 0.02495 0 1 0.0
Ni4 Ni 0.44436 0.13723 0 1 0.0
Sb3 Sb 0.28595 0.10484 0.24949 0.41 0.0
Ni5 Ni 0.69464 0.29083 0 1 0.0
Ni3 Ni 0.1918 0.00229 0 1 0.0
Ni7 Ni 0.75676 0.14668 0 0.21 0.0
Nb3 Nb 0.09989 0.16209 0 1 0.0
Nb6 Nb 0.40087 0.55016 0 1 0.0
Nb2 Nb 0.08693 0.73064 0 1 0.0
Nb4 Nb 0.21753 0.44618 0 1 0.0
Ni2 Ni 0.40816 0.39308 0.23934 1 0.0
Nb1 Nb 0.02254 0.57316 0 1 0.0
Ni1 Ni 0.09926 0.32456 0.23441 1 0.0
Ni6 Ni 0.28595 0.10484 0.24949 0.59 0.0
Sb4 Sb 0.75676 0.14668 0 0.79 0.0
Nb5 Nb 0.2794 0.26523 0 1 0.0
