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#$Date: 2013-05-09 16:53:25 +0300 (Thu, 09 May 2013) $
#$Revision: 86000 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/01/57/9015725.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/. The original data for this entry
# were provided the American Mineralogist Crystal Structure Database,
# http://rruff.geo.arizona.edu/AMS/amcsd.php
#
# The file may be used within the scientific community so long as
# proper attribution is given to the journal article from which the
# data were obtained.
#
data_9015725
loop_
_publ_author_name
'Schobinger-Papamantellos P'
'Oleksyn, O.'
'Rodriguez-Carvajal J'
'Andre, G.'
'Brueck, E.'
'Buschow, K.'
_publ_section_title
;
 Atomic disorder, magnetic order and phase transitions of Tb Fe6 Ge6
 studied by X-ray, neutron diffraction and magnetic measurement (I).
 _cod_database_code 1006165
;
_journal_name_full               'Journal of Magnetism and Magnetic Materials'
_journal_page_first              96
_journal_page_last               110
_journal_volume                  182
_journal_year                    1998
_chemical_formula_sum            'Fe3 Ge3 Tb0.5'
_space_group_IT_number           63
_symmetry_space_group_name_Hall  '-C 2c 2'
_symmetry_space_group_name_H-M   'C m c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   8.1293
_cell_length_b                   17.73192
_cell_length_c                   5.11877
_cell_volume                     737.861
_database_code_amcsd             0013066
_exptl_crystal_density_diffrn    8.369
_[local]_cod_chemical_formula_sum_orig 'Tb.5 Ge3 Fe3'
_cod_database_code               9015725
_amcsd_formula_title             'Fe6 Ge6 Tb'
loop_
_space_group_symop_operation_xyz
x,y,z
1/2+x,1/2+y,z
x,-y,1/2+z
1/2+x,1/2-y,1/2+z
-x,y,1/2-z
1/2-x,1/2+y,1/2-z
-x,y,z
1/2-x,1/2+y,z
x,-y,-z
1/2+x,1/2-y,-z
x,y,1/2-z
1/2+x,1/2+y,1/2-z
-x,-y,1/2+z
1/2-x,1/2-y,1/2+z
-x,-y,-z
1/2-x,1/2-y,-z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
Tb1 0.00000 0.12200 0.25000 0.89000
Tb2 0.50000 0.12800 0.25000 0.11000
Ge1 0.00000 0.03900 0.75000 1.00000
Ge2 0.50000 0.04400 0.75000 1.00000
Ge3 0.00000 0.20800 0.75000 1.00000
Ge4 0.50000 0.20270 0.75000 1.00000
Ge5 0.34750 0.12570 0.25000 0.89000
Ge6 0.84750 0.12430 0.25000 0.11000
Fe1 0.25000 0.25000 0.00000 1.00000
Fe2 0.25090 0.00000 0.00000 1.00000
Fe3 0.25090 0.12330 0.75000 1.00000