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#$Date: 2015-09-19 01:02:55 +0300 (Sat, 19 Sep 2015) $
#$Revision: 158158 $
#$URL: svn://www.crystallography.net/cod/cif/4/00/25/4002541.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_4002541
loop_
_publ_author_name
'Zhuravleva, M.A.'
'Chen, X.Z.'
'Kannewurf, C.R.'
'Wang, X.-P.'
'Schultz, A.J.'
'Kanatzidis, M.G.'
'Ireland, J.'
_publ_section_title
;
 X-ray and neutron structure determination and magnetic properties of new
 quaternary phases RE0.67 Ni2 Ga5+n-x Gex and RE0.67 Ni2 Ga5+n-x Six (n=
 0,1; RE= Y, Sm, Gd, Tb, Dy, Ho, Er, Tm) synthesized in liquid Ga
;
_journal_name_full               'Chemistry of Materials (1,1989-)'
_journal_page_first              3066
_journal_page_last               3081
_journal_volume                  14
_journal_year                    2002
_chemical_formula_sum            'Ga4.33 Ge0.67 Ni2 Y0.67'
_chemical_name_systematic        'Y0.67 Ni2 Ga4.33 Ge0.67'
_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            2
_cell_length_a                   4.179
_cell_length_b                   4.179
_cell_length_c                   15.993
_cell_volume                     241.883
_citation_journal_id_ASTM        CMATEX
_cod_data_source_file            Zhuravleva_CMATEX_2002_622.cif
_cod_data_source_block           Ga4.33Ge0.67Ni2Y0.67
_cod_database_code               4002541
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
Ga2 Ga 0 0 0.13351 0.67 0.0
Ni1 Ni 0.3333 0.6667 0.60897 1 0.0
Ga1 Ga 0.5408 0.0816 0.25 0.33 0.0
Ge1 Ge 0 0 0.13351 0.33 0.0
Ga3 Ga 0.3333 0.6667 0.0459 1 0.0
Y1 Y 0.3333 0.6667 0.25 0.67 0.0
