data_stdin
_audit_creation_method 'critic2-4f1eba8'
_cell_length_a         7.6030000000
_cell_length_b         7.6030000000
_cell_length_c         5.3580000000
_cell_angle_alpha        90.0000
_cell_angle_beta        90.0000
_cell_angle_gamma        90.0000
_cell_volume           309.722453
_space_group_crystal_system tetragonal
_space_group_IT_number 115
_space_group_name_H-M_alt 'P-4m2'
_space_group_name_Hall 'P -4 -2'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'y,-x,-z'
  '-x,-y,z'
  '-y,x,-z'
  'x,-y,z'
  'y,x,-z'
  '-x,y,z'
  '-y,-x,-z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Sn     Sn     0.00000000000000     0.00000000000000     0.00000000000000
Cu     Cu     0.50000000000000     0.00000000000000     0.00020000000000
Cu     Cu     0.24630000000000     0.24630000000000     0.50000000000000
Fe     Fe     0.50000000000000     0.50000000000000     0.00000000000000
Fe     Fe     0.50000000000000     0.50000000000000     0.50000000000000
S      S      0.26150000000000     0.00000000000000     0.25380000000000
S      S      0.25970000000000     0.50000000000000     0.24900000000000
