#------------------------------------------------------------------------------
#$Date: 2016-02-13 21:28:24 +0200 (Sat, 13 Feb 2016) $
#$Revision: 176429 $
#$URL: svn://www.crystallography.net/cod/cif/1/52/19/1521972.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_1521972
loop_
_publ_author_name
'Soubeyroux, J.L.'
'Fruchart, D.'
'Biris, A.S.'
_publ_section_title
;
 Structural studies of Laves phases Zr Co (V1-x Crx) with 0<x<1 and their
 hydrides
;
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              88
_journal_page_last               92
_journal_volume                  293
_journal_year                    1999
_chemical_formula_sum            'Co Cr0.522 D3.42 V0.478 Zr'
_chemical_name_systematic        'Zr Co V0.478 Cr0.522 D3.42'
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            4
_cell_length_a                   5.347
_cell_length_b                   5.347
_cell_length_c                   8.745
_cell_volume                     216.526
_citation_journal_id_ASTM        JALCEU
_cod_data_source_file            Soubeyroux_JALCEU_1999_47.cif
_cod_data_source_block           D3.42Co1Cr0.522V0.478Zr1
_cod_original_cell_volume        216.5264
_cod_original_formula_sum        'D3.42 Co1 Cr0.522 V0.478 Zr1'
_cod_database_code               1521972
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
x-y,x,z+1/2
-y,x-y,z
-x,-y,z+1/2
-x+y,-x,z
y,-x+y,z+1/2
-y,-x,-z+1/2
x-y,-y,-z
x,x-y,-z+1/2
y,x,-z
-x+y,y,-z+1/2
-x,-x+y,-z
-x,-y,-z
-x+y,-x,-z-1/2
y,-x+y,-z
x,y,-z-1/2
x-y,x,-z
-y,x-y,-z-1/2
y,x,z-1/2
-x+y,y,z
-x,-x+y,z-1/2
-y,-x,z
x-y,-y,z-1/2
x,x-y,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
D1 D 0.046 0.327 0.565 0.27 0.0
D3 D 0.461 0.922 0.25 0.36 0.0
Cr2 Cr 0.829 0.658 0.25 0.265 0.0
D4 D 0.21 0.42 0.25 0.2 0.0
V1 V 0 0 0 0.252 0.0
D2 D 0.453 0.906 0.634 0.32 0.0
Cr1 Cr 0 0 0 0.248 0.0
Co2 Co 0.829 0.658 0.25 0.5 0.0
V2 V 0.829 0.658 0.25 0.235 0.0
Zr1 Zr 0.3333 0.6667 0.0626 1 0.0
Co1 Co 0 0 0 0.5 0.0
