#------------------------------------------------------------------------------
#$Date: 2008-01-26 15:05:32 +0200 (Sat, 26 Jan 2008) $
#$Revision: 19 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9008429.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_9008429
_chemical_name 'RbCu2(SO4)2(OH)(H2O)'
loop_
_publ_author_name
'Chevrier G'
'Giester G'
'Zemann J'
_journal_name_full "Zeitschrift fur Kristallographie"
_journal_volume 206
_journal_year 1993
_journal_page_first 7
_journal_page_last 14
_publ_section_title
;
 Neutron refinements of NaCu2(H3O2)(SO4)2 and RbCu2(H3O2)(SeO4)2:
 Variation of the hydrogen bond system in the natrochalcite-type series
 Locality: synthetic
;
_chemical_formula_sum 'Rb Cu2 S2 O10 H3'
_cell_length_a 9.246
_cell_length_b 6.483
_cell_length_c 7.940
_cell_angle_alpha 90
_cell_angle_beta 116.11
_cell_angle_gamma 90
_cell_volume 427.369
_symmetry_space_group_name_H-M 'C 1 2/m 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'
  '-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
Rb1   0.00000   0.50000   0.50000   1.00000
Cu1   0.25000   0.25000   0.00000   1.00000
S1   0.07200   0.00000   0.27890   1.00000
O1   0.18740   0.00000   0.16970   1.00000
O2   0.18010   0.00000   0.50290   1.00000
O3  -0.04130   0.20930   0.21610   1.00000
O-h   0.15650   0.50000   0.07270   1.00000
H1   0.02770   0.50000   0.02100   0.50000
H2   0.19720   0.50000   0.20890   1.00000