data_stdin
_audit_creation_method 'critic2-4f1eba8'
_cell_length_a         6.4290000000
_cell_length_b         6.4290000000
_cell_length_c         6.6110000000
_cell_angle_alpha        90.0000
_cell_angle_beta        90.0000
_cell_angle_gamma        90.0000
_cell_volume           273.246123
_space_group_crystal_system tetragonal
_space_group_IT_number 84
_space_group_name_H-M_alt 'P4_2/m'
_space_group_name_Hall '-P 4c'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-y,-z'
  '-y,x,-1/2+z'
  'y,-x,-1/2-z'
  '-x,-y,z'
  'x,y,-z'
  'y,-x,-1/2+z'
  '-y,x,-1/2-z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Pd     Pd     0.00000000000000     0.00000000000000     0.25000000000000
Pd     Pd     0.50000000000000     0.00000000000000     0.00000000000000
Pd     Pd     0.25713000000000     0.46779000000000     0.00000000000000
S      S      0.30754000000000     0.19361000000000     0.22904000000000
