data_image0
_chemical_formula_structural       Pt2S4
_chemical_formula_sum              "Pt2 S4"
_cell_length_a       5.471789239808754
_cell_length_b       5.560271077419636
_cell_length_c       16.324422163229553
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  'x, y, z'

loop_
  _atom_site_type_symbol
  _atom_site_label
  _atom_site_symmetry_multiplicity
  _atom_site_fract_x
  _atom_site_fract_y
  _atom_site_fract_z
  _atom_site_occupancy
  Pt  Pt1       1.0  0.4999999981899198  2.862391836947007e-19  0.49999999990108224  1.0000
  Pt  Pt2       1.0  0.0  0.5000000002320357  0.49999999990108224  1.0000
  S   S1        1.0  0.10757027257514991  0.11383278282427373  0.46064999819340047  1.0000
  S   S2        1.0  0.6075702945232947  0.3861672030199743  0.5393499887446026  1.0000
  S   S3        1.0  0.8924297274598012  0.8861672176397978  0.5393500016087639  1.0000
  S   S4        1.0  0.3924297055116564  0.6138327974440972  0.4606500104449827  1.0000