#------------------------------------------------------------------------------
#$Date: 2016-01-01 11:32:32 +0100 (vie 01 de ene de 2016) $
#$Revision: 171933 $
#$URL: svn://www.crystallography.net/cod/cif/1/54/08/1540800.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_1540800
loop_
_publ_author_name
'Yoshida, H.'
'Kaneko, T.'
'Yuzuri, M.'
'Adachi, Y.'
'Kanomata, T.'
'Suzuki, T.'
_publ_section_title
;
 Spontaneous volume magnetostriction in Cr Te1-x Sex
;
_journal_name_full               'Journal of Magnetism and Magnetic Materials'
_journal_page_first              1983
_journal_page_last               1984
_journal_volume                  104
_journal_year                    1992
_chemical_formula_sum            'Cr2 Se0.4 Te1.6'
_chemical_name_systematic        '(Cr5 Se Te4)0.4'
_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            1
_cell_length_a                   3.95
_cell_length_b                   3.95
_cell_length_c                   6.227
_cell_volume                     84.140
_citation_journal_id_ASTM        JMMMDC
_cod_data_source_file            Yoshida_JMMMDC_1992_802.cif
_cod_data_source_block           Cr2Se0.4Te1.6
_cod_original_cell_volume        84.14024
_cod_database_code               1540800
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
Te1 Te 0.3333 0.6667 0.25 0.8 0.0
Se1 Se 0.3333 0.6667 0.25 0.2 0.0
Cr1 Cr 0 0 0 1 0.0
