#------------------------------------------------------------------------------
#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9004520.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_9004520
_chemical_name 'Edoylerite'
loop_
_publ_author_name
'Burns P C'
_journal_name_full "The Canadian Mineralogist"
_journal_volume 37
_journal_year 1999
_journal_page_first 113
_journal_page_last 118
_publ_section_title
;
 The structure of edoylerite determined from a microcrystal
;
_chemical_formula_sum 'Hg3 Cr S2 O4'
_cell_length_a 7.5283
_cell_length_b 14.8325
_cell_length_c 7.4629
_cell_angle_alpha 90
_cell_angle_beta 118.746
_cell_angle_gamma 90
_cell_volume 730.634
_symmetry_space_group_name_H-M 'P 1 21/c 1'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  'x,1/2-y,1/2+z'
  '-x,1/2+y,1/2-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_Uiso_or_equiv
Hg1   0.16730   0.04320   0.36810   0.02650
Hg2   0.10330   0.14370  -0.08140   0.02560
Hg3   0.59520   0.16330   0.39760   0.02440
Cr   0.62000   0.09590   0.89170   0.01630
S1   0.24000   0.18650   0.26800   0.01780
S2  -0.06900   0.10340  -0.43100   0.02120
O1   0.49100   0.12300   0.00700   0.04300
O2   0.69300   0.19100   0.82000   0.04380
O3   0.48700   0.03300   0.69800   0.05330
O4   0.82400   0.03600   0.03700   0.03710