#------------------------------------------------------------------------------
#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9004188.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_9004188
_chemical_name 'Chlorite'
loop_
_publ_author_name
'Bailey S W'
_journal_name_full "The Canadian Mineralogist"
_journal_volume 24
_journal_year 1986
_journal_page_first 649
_journal_page_last 654
_publ_section_title
;
 Re-evaluation of ordering and local charge-balance in Ia chlorite
;
_chemical_formula_sum 'Si3 Al1.2 Mg5 Fe.1 Cr.7 O18 H7.9'
_cell_length_a 5.329
_cell_length_b 9.246
_cell_length_c 14.442
_cell_angle_alpha 90.
_cell_angle_beta 97.1
_cell_angle_gamma 90.
_cell_volume 706.129
_symmetry_space_group_name_H-M 'C -1'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '1/2+x,1/2+y,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
SiT1   0.39680  -0.00010   0.19060   0.75000
AlT1   0.39680  -0.00010   0.19060   0.12500
SiT2   0.89700   0.16670   0.19080   0.75000
AlT2   0.89700   0.16670   0.19080   0.37500
MgM1   0.00000   0.00000   0.00000   1.00000
MgM2  -0.00090   0.33340   0.00006   1.00000
MgM3   0.00120   0.16660   0.50314   1.00000
FeM4   0.50000   0.00000   0.50000   0.10000
CrM4   0.50000   0.00000   0.50000   0.70000
AlM4   0.50000   0.00000   0.50000   0.20000
O1   0.35900   0.00000   0.07660   1.00000
O2   0.85880   0.16670   0.07670   1.00000
O-h1   0.35780   0.33310   0.07340   1.00000
O3   0.14670   0.06910   0.23190   1.00000
O4   0.64630   0.09670   0.23180   1.00000
O5   0.93830   0.33330   0.23200   1.00000
O-h2   0.15170   0.00180   0.42910   1.00000
O-h3   0.13590   0.33680   0.42920   1.00000
O-h4   0.64150   0.16160   0.42920   1.00000
H1   0.36700   0.33140   0.14050   1.00000
H2   0.09680   0.01890   0.37140   1.00000
H3   0.08160   0.33560   0.36810   1.00000
H4   0.61810   0.15250   0.37300   0.95000