data_global
_chemical_name_mineral 'Stilbite-Ca'
loop_
_publ_author_name
'Akizuki M'
'Kudoh Y'
'Satoh Y'
_journal_name_full 'European Journal of Mineralogy'
_journal_volume 5 
_journal_year 1993
_journal_page_first 839
_journal_page_last 843
_publ_section_title
;
 Crystal structure of the orthorhombic {001} growth sector of stilbite
;
_database_code_amcsd 0006490
_chemical_formula_sum 'Ca.945 Mg.107 Na.188 (Si6.66 Al2.34) O25.28 H14.56'
_cell_length_a 13.616
_cell_length_b 18.238
_cell_length_c 17.835
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 4428.940
_exptl_crystal_density_diffrn      2.142
_symmetry_space_group_name_H-M 'F m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2+y,1/2+z'
  '1/2+x,y,1/2+z'
  '1/2+x,1/2+y,z'
  'x,-y,z'
  'x,1/2-y,1/2+z'
  '1/2+x,-y,1/2+z'
  '1/2+x,1/2-y,z'
  '-x,y,-z'
  '-x,1/2+y,1/2-z'
  '1/2-x,y,1/2-z'
  '1/2-x,1/2+y,-z'
  '-x,y,z'
  '-x,1/2+y,1/2+z'
  '1/2-x,y,1/2+z'
  '1/2-x,1/2+y,z'
  'x,-y,-z'
  'x,1/2-y,1/2-z'
  '1/2+x,-y,1/2-z'
  '1/2+x,1/2-y,-z'
  'x,y,-z'
  'x,1/2+y,1/2-z'
  '1/2+x,y,1/2-z'
  '1/2+x,1/2+y,-z'
  '-x,-y,z'
  '-x,1/2-y,1/2+z'
  '1/2-x,-y,1/2+z'
  '1/2-x,1/2-y,z'
  '-x,-y,-z'
  '-x,1/2-y,1/2-z'
  '1/2-x,-y,1/2-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
_atom_site_U_iso_or_equiv
Ca   0.50000   0.00000   0.29390   0.94500   0.05180
Mg   0.50000   0.00000   0.29390   0.05500   0.05180
Na   0.20220   0.44420   0.27820   0.04700   0.07004
Mg   0.20220   0.44420   0.27820   0.01300   0.07004
Si1   0.38600   0.30700   0.37640   0.74000   0.01494
Al1   0.38600   0.30700   0.37640   0.26000   0.01494
Si3   0.30230   0.41100   0.50000   0.74000   0.01418
Al3   0.30230   0.41100   0.50000   0.26000   0.01418
Si4   0.38830   0.18310   0.50000   0.74000   0.01241
Al4   0.38830   0.18310   0.50000   0.26000   0.01241
Si5   0.25000   0.25000   0.25000   0.74000   0.01938
Al5   0.25000   0.25000   0.25000   0.26000   0.01938
O1   0.31830   0.30390   0.30130   1.00000   0.03559
O3   0.37190   0.23210   0.42490   1.00000   0.03179
O4   0.35600   0.38020   0.42380   1.00000   0.03698
O7   0.50000   0.31610   0.34770   1.00000   0.03052
O8   0.31580   0.11360   0.50000   1.00000   0.03192
O9   0.30830   0.50000   0.50000   1.00000   0.02875
O10   0.50000   0.14930   0.50000   1.00000   0.03204
Wat1   0.00000   0.37280   0.30200   0.97000   0.13324
Wat2   0.04170   0.50000   0.42170   0.46000   0.11665
Wat3   0.09980   0.50000   0.17770   0.97000   0.20150
Wat4   0.13340   0.50000   0.37490   0.40000   0.13336
Wat5   0.14260   0.41710   0.31350   0.42000   0.16667