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#$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $
#$Revision: 14 $
#$URL: file:///home/coder/svn-repositories/cod/cif/9/9009939.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_9009939
_chemical_name 'Yafsoanite'
loop_
_publ_author_name
'Rozhdestvenskaya I V'
'Zajakina N V'
'Kim A A'
_journal_name_full "Mineralogiceskij Zhurnal"
_journal_volume 6
_journal_year 1984
_journal_page_first 75
_journal_page_last 79
_publ_section_title
;
 Crystal structure of a zinc calcium tellurate - yafsoanite
;
_chemical_formula_sum 'Zn2.61 Pb.51 Te2.09 Ca2.64 O12'
_cell_length_a 12.621
_cell_length_b 12.621
_cell_length_c 12.621
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 2010.395
_symmetry_space_group_name_H-M 'I 41 3 2'
loop_
_symmetry_equiv_pos_as_xyz
  'x,y,z'
  '1/2+x,1/2+y,1/2+z'
  '-z,1/2+x,1/2-y'
  '1/2-z,+x,-y'
  '-y,1/2+z,1/2-x'
  '1/2-y,+z,-x'
  '-x,1/2+y,1/2-z'
  '1/2-x,+y,-z'
  '3/4-x,1/4+z,3/4+y'
  '1/4-x,3/4+z,1/4+y'
  '3/4-z,1/4+y,3/4+x'
  '1/4-z,3/4+y,1/4+x'
  '3/4-y,1/4+x,3/4+z'
  '1/4-y,3/4+x,1/4+z'
  '1/4-x,1/4-z,1/4-y'
  '3/4-x,3/4-z,3/4-y'
  '1/4-z,1/4-y,1/4-x'
  '3/4-z,3/4-y,3/4-x'
  '1/4-y,1/4-x,1/4-z'
  '3/4-y,3/4-x,3/4-z'
  '1/2-z,-x,1/2+y'
  '-z,1/2-x,+y'
  '1/2-y,-z,1/2+x'
  '-y,1/2-z,+x'
  '1/2-x,-y,1/2+z'
  '-x,1/2-y,+z'
  '1/2+z,1/2-x,-y'
  '+z,-x,1/2-y'
  '1/2+y,1/2-z,-x'
  '+y,-z,1/2-x'
  '1/2+x,1/2-y,-z'
  '+x,-y,1/2-z'
  '3/4+x,3/4-z,1/4+y'
  '1/4+x,1/4-z,3/4+y'
  '3/4+z,3/4-y,1/4+x'
  '1/4+z,1/4-y,3/4+x'
  '3/4+y,3/4-x,1/4+z'
  '1/4+y,1/4-x,3/4+z'
  '1/4+x,3/4+z,3/4-y'
  '3/4+x,1/4+z,1/4-y'
  '1/4+z,3/4+y,3/4-x'
  '3/4+z,1/4+y,1/4-x'
  '1/4+y,3/4+x,3/4-z'
  '3/4+y,1/4+x,1/4-z'
  'z,x,y'
  '1/2+z,1/2+x,1/2+y'
  'y,z,x'
  '1/2+y,1/2+z,1/2+x'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_Uiso_or_equiv
Zn   0.24057   0.00943   0.12500   0.87000   0.00975
Pb   0.24057   0.00943   0.12500   0.09000   0.00975
Te   0.24057   0.00943   0.12500   0.02000   0.00975
Ca   0.25250   0.50250   0.12500   0.88000   0.00798
Pb   0.25250   0.50250   0.12500   0.08000   0.00798
Te   0.25250   0.50250   0.12500   0.01000   0.00798
Te   0.00443   0.00443   0.00443   1.00000   0.00887
O1   0.13980  -0.03850  -0.02600   1.00000   0.01127
O2   0.85750   0.05880   0.03140   1.00000   0.01469