data_global
_chemical_name_mineral 'Gladite'
loop_
_publ_author_name
'Kohatsu I'
'Wuensch B J'
_journal_name_full 'Acta Crystallographica, Section B'
_journal_volume 32 
_journal_year 1976
_journal_page_first 2401
_journal_page_last 2409
_publ_section_title
;
 The crystal structure of gladite, PbCuBi5S9, a superstructure intermediate in
 the series Bi2S3-PbCuBiS3 (bismuthinite-aikinite)
;
_database_code_amcsd 0009571
_chemical_formula_sum 'Pb Cu Bi5 S9'
_cell_length_a 33.531
_cell_length_b 11.486
_cell_length_c 4.003
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 1541.703
_exptl_crystal_density_diffrn      6.912
_symmetry_space_group_name_H-M 'P b n m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,y,1/2-z'
  '-x,-y,1/2+z'
  '1/2+x,1/2-y,1/2+z'
  '1/2-x,1/2+y,1/2-z'
  '1/2-x,1/2+y,z'
  '1/2+x,1/2-y,-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Pb   0.33490   0.31740   0.25000
Cu   0.23900   0.22000   0.25000
Bi1   0.05650   0.02090   0.25000
Bi2   0.39240   0.00560   0.25000
Bi3   0.72940   0.02830   0.25000
Bi4   0.65500   0.35420   0.25000
Bi5   0.98660   0.34300   0.25000
S1   0.20950   0.03540   0.25000
S2   0.54150   0.05520   0.25000
S3   0.88040   0.05650   0.25000
S4   0.18550   0.37860   0.25000
S5   0.51720   0.37600   0.25000
S6   0.85110   0.39170   0.25000
S7   0.10060   0.21580   0.25000
S8   0.43440   0.20380   0.25000
S9   0.76690   0.22900   0.25000
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 0.01139 0.01871 0.01624 -0.00429 0.00000 0.00000
Cu 0.00684 0.00334 0.00487 0.00039 0.00000 0.00000
Bi1 0.01424 0.01337 0.00893 0.00195 0.00000 0.00000
Bi2 0.01709 0.01805 0.01299 0.00137 0.00000 0.00000
Bi3 0.02563 0.01069 0.00812 -0.00098 0.00000 0.00000
Bi4 0.01937 0.02206 0.01542 0.00351 0.00000 0.00000
Bi5 0.01082 0.01671 0.01542 0.00039 0.00000 0.00000
S1 0.01082 0.00936 0.00812 -0.00215 0.00000 0.00000
S2 0.02335 0.02072 0.02435 -0.00156 0.00000 0.00000
S3 0.01253 0.01805 0.01624 0.00137 0.00000 0.00000
S4 0.00456 0.00735 0.00893 0.00078 0.00000 0.00000
S5 0.01481 0.01871 0.01786 0.00078 0.00000 0.00000
S6 0.02620 0.02339 0.01624 -0.00312 0.00000 0.00000
S7 0.00057 0.00334 0.00081 -0.00078 0.00000 0.00000
S8 0.02221 0.02272 0.03166 -0.00117 0.00000 0.00000
S9 0.02563 0.02473 0.02273 0.00117 0.00000 0.00000