data_global
_chemical_name_mineral 'Osarizawaite'
loop_
_publ_author_name
'Giuseppetti G'
'Tadini C'
_journal_name_full 'Neues Jahrbuch fur Mineralogie, Monatshefte'
_journal_volume 1980 
_journal_year 1980
_journal_page_first 401
_journal_page_last 407
_publ_section_title
;
 The crystal structure of osarizawaite
;
_database_code_amcsd 0014767
_chemical_compound_source 'Osarizawa mine, Akita Prefecture, Honshu, Japan'
_chemical_formula_sum 'Pb (Cu.99 Al1.62 Fe.39) S2 O14 H6'
_cell_length_a 7.075
_cell_length_b 7.075
_cell_length_c 17.248
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 747.691
_exptl_crystal_density_diffrn      4.196
_symmetry_space_group_name_H-M 'R -3 m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '2/3+x,1/3+y,1/3+z'
  '1/3+x,2/3+y,2/3+z'
  'x,x-y,z'
  '2/3+x,1/3+x-y,1/3+z'
  '1/3+x,2/3+x-y,2/3+z'
  'y,x,-z'
  '2/3+y,1/3+x,1/3-z'
  '1/3+y,2/3+x,2/3-z'
  '-x+y,y,z'
  '2/3-x+y,1/3+y,1/3+z'
  '1/3-x+y,2/3+y,2/3+z'
  '-x,-x+y,-z'
  '2/3-x,1/3-x+y,1/3-z'
  '1/3-x,2/3-x+y,2/3-z'
  '-y,-x,z'
  '2/3-y,1/3-x,1/3+z'
  '1/3-y,2/3-x,2/3+z'
  'x-y,-y,-z'
  '2/3+x-y,1/3-y,1/3-z'
  '1/3+x-y,2/3-y,2/3-z'
  'y,-x+y,-z'
  '2/3+y,1/3-x+y,1/3-z'
  '1/3+y,2/3-x+y,2/3-z'
  '-x+y,-x,z'
  '2/3-x+y,1/3-x,1/3+z'
  '1/3-x+y,2/3-x,2/3+z'
  '-x,-y,-z'
  '2/3-x,1/3-y,1/3-z'
  '1/3-x,2/3-y,2/3-z'
  '-y,x-y,z'
  '2/3-y,1/3+x-y,1/3+z'
  '1/3-y,2/3+x-y,2/3+z'
  'x-y,x,-z'
  '2/3+x-y,1/3+x,1/3-z'
  '1/3+x-y,2/3+x,2/3-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
Pb   0.00000   0.00000   0.00000   1.00000   0.04648
Cu  -0.50000   0.00000   0.50000   0.33000   0.01051
Al  -0.50000   0.00000   0.50000   0.54000   0.01051
Fe  -0.50000   0.00000   0.50000   0.13000   0.01051
S   0.00000   0.00000   0.31060   1.00000   0.01811
O1   0.00000   0.00000   0.39420   1.00000   0.03065
O2   0.22000  -0.22000  -0.05280   1.00000   0.02723
O-h   0.12520  -0.12520   0.13470   1.00000   0.01482
H   0.19080  -0.19080   0.12170   1.00000   0.02267
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Pb 0.03690 0.03690 0.06631 0.01845 0.00000 0.00000
Cu 0.00913 0.00799 0.01356 0.00399 0.00000 0.00054
Al 0.00913 0.00799 0.01356 0.00399 0.00000 0.00054
Fe 0.00913 0.00799 0.01356 0.00399 0.00000 0.00054
S 0.01179 0.01179 0.03014 0.00590 0.00000 0.00000
O1 0.03195 0.03195 0.02713 0.01598 0.00000 0.00000
O2 0.01921 0.01921 0.04823 0.01274 -0.00107 0.00107
O-h 0.01065 0.01065 0.02261 0.00475 0.00000 0.00000