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#$Date: 2015-01-27 20:58:39 +0100 (Tue 27 de Jan de 2015) $
#$Revision: 130149 $
#$URL: svn://www.crystallography.net/cod/cif/1/00/50/1005037.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_1005037
loop_
_publ_author_name
'Gordon, R A'
'Warren, C J'
'Alexander, M G'
'DiSalvo, F J'
'Poettgen, R'
_publ_section_title
;
Substitution in Ce2 T Si3 intermetallic compositions with T = (Cr, Mn,
Fe, Co, or Ni)x (Pd or Au)1-x
;
_journal_coden_ASTM              JALCEU
_journal_name_full               'Journal of Alloys Compd.'
_journal_page_first              24
_journal_page_last               32
_journal_paper_doi               10.1016/S0925-8388(96)02624-2
_journal_volume                  248
_journal_year                    1997
_chemical_formula_structural     'Ce2 Co Si3'
_chemical_formula_sum            'Ce2 Co Si3'
_chemical_name_systematic        'Cerium cobalt silicide (2/1/3)'
_space_group_IT_number           191
_symmetry_cell_setting           hexagonal
_symmetry_Int_Tables_number      191
_symmetry_space_group_name_Hall  '-P 6 2'
_symmetry_space_group_name_H-M   'P 6/m m m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_formula_units_Z            2
_cell_length_a                   8.104(2)
_cell_length_b                   8.104(2)
_cell_length_c                   4.197(2)
_cell_volume                     238.7
_refine_ls_R_factor_all          0.027
_cod_database_code               1005037
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-y,x-y,z
y-x,-x,z
y,x,z
x-y,-y,z
-x,y-x,z
-x,-y,z
y,y-x,z
x-y,x,z
-y,-x,z
y-x,y,z
x,x-y,z
-x,-y,-z
y,y-x,-z
x-y,x,-z
-y,-x,-z
y-x,y,-z
x,x-y,-z
x,y,-z
-y,x-y,-z
y-x,-x,-z
y,x,-z
x-y,-y,-z
-x,y-x,-z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_symmetry_multiplicity
_atom_site_Wyckoff_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_attached_hydrogens
_atom_site_calc_flag
Ce1 Ce0 1 a 0. 0. 0. 1. 0 d
Ce2 Ce0 3 f 0.5 0. 0. 1. 0 d
Co1 Co0 2 d 0.3333 0.6667 0.5 1. 0 d
Si1 Si0 6 m 0.1702(1) 0.3403(2) 0.5 1. 0 d
loop_
_atom_type_symbol
_atom_type_oxidation_number
Ce0 0.000
Co0 0.000
Si0 0.000
