data_stdin
_audit_creation_method 'critic2-4f1eba8'
_cell_length_a         8.3200000000
_cell_length_b         9.6400000000
_cell_length_c         4.8200000000
_cell_angle_alpha        90.0000
_cell_angle_beta        90.0000
_cell_angle_gamma        90.0000
_cell_volume           386.587136
_space_group_crystal_system orthorhombic
_space_group_IT_number 18
_space_group_name_H-M_alt 'P2_12_12'
_space_group_name_Hall 'P 2 2ab'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-y,z'
  '-1/2+x,-1/2-y,-z'
  '-1/2-x,-1/2+y,-z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Ba     Ba     0.00000000000000     0.00000000000000     0.00000000000000
Ba     Ba     0.00000000000000     0.50000000000000     0.00000000000000
S      S      0.25000000000000     0.25000000000000     0.00000000000000
S      S      0.25000000000000     0.50000000000000     0.50000000000000
S      S      0.12400000000000     0.30900000000000     0.38200000000000
