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#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/66/1526689.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_1526689
loop_
_publ_author_name
'Koblyuk, N.D.'
'Melnyk, G.A.'
'Romaka, L.P.'
'Fruchart, D.'
'Bodak, O.I.'
_publ_section_title
;
 Crystal structure of Zr2 Cu Sb3 and related compounds
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              284
_journal_page_last               286
_journal_volume                  317
_journal_year                    2001
_chemical_formula_sum            'Cu Sb3 Zr2'
_chemical_name_systematic        'Zr2 Cu Sb3'
_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                   3.9404
_cell_length_b                   3.9404
_cell_length_c                   8.6971
_cell_volume                     135.038
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Koblyuk_JALCEU_2001_1219.cif
_cod_data_source_block           Cu1Sb3Zr2
_cod_original_cell_volume        135.0377
_cod_original_formula_sum        'Cu1 Sb3 Zr2'
_cod_database_code               1526689
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
Cu1 Cu 0 0 0 1 0.0
Zr1 Zr 0 0.5 0.7365 1 0.0
Sb1 Sb 0.5 0.5 0 1 0.0
Sb2 Sb 0 0.5 0.3835 1 0.0
