data_global
_chemical_name_mineral 'Bismuthinite'
loop_
_publ_author_name
'Lundegaard L F'
'Makovicky E'
'Boffa Ballaran T'
'Balic-Zunic T'
_journal_name_full 'Physics and Chemistry of Minerals'
_journal_volume 32 
_journal_year 2005
_journal_page_first 578
_journal_page_last 584
_publ_section_title
;
 Crystal structure and cation lone electron pair activity of Bi2S3 between 0 and 10 GPa
 Sample: P = 7.22 GPa
;
_database_code_amcsd 0009009
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'Bi2 S3'
_cell_length_a 10.701
_cell_length_b 3.8655
_cell_length_c 10.565
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 437.018
_exptl_crystal_density_diffrn      7.815
_symmetry_space_group_name_H-M 'P n m a'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2-y,z'
  '-x,1/2+y,-z'
  '1/2-x,1/2+y,1/2+z'
  '1/2+x,1/2-y,1/2-z'
  '1/2+x,y,1/2-z'
  '1/2-x,-y,1/2+z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Bi1  -0.00290   0.25000   0.67440   0.01600
Bi2   0.32750   0.25000   0.46740   0.01770
S1   0.04930   0.25000   0.12960   0.01100
S2   0.37450   0.25000   0.06070   0.01600
S3   0.22320   0.25000   0.79900   0.01300