#------------------------------------------------------------------------------
#$Date: 2009-11-18 16:56:34 +0200 (Wed, 18 Nov 2009) $
#$Revision: 858 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9001248.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_9001248
loop_
_publ_author_name
'Bayliss P'
_publ_section_title
;
 Crystal chemistry and crystallography of some minerals within the pyrite group
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1168
_journal_page_last               1176
_journal_volume                  74
_journal_year                    1989
_chemical_formula_sum            'Ir S Sb'
_[local]_cod_chemical_formula_sum_orig 'Ir Sb S'
_chemical_name_mineral           Tolovkite
_symmetry_space_group_name_H-M   'P c a 21'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   6.025
_cell_length_b                   6.025
_cell_length_c                   6.025
_cell_volume                     218.711
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
1/2+x,-y,z
1/2-x,y,1/2+z
-x,-y,1/2+z
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Ir -0.00670 0.26120 0.00220 0.00253
Sb 0.37760 0.62760 0.37760 0.00507
S 0.62240 0.87240 0.62240 0.01013