# generated using pymatgen
data_TlPt2S3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.14374897
_cell_length_b   7.14374897
_cell_length_c   6.08520538
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000470
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TlPt2S3
_chemical_formula_sum   'Tl2 Pt4 S6'
_cell_volume   268.94174703
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  Tl  Tl0  1  0.66666700  0.33333300  0.62634094  1.0
  Tl  Tl1  1  0.33333300  0.66666700  0.37365906  1.0
  Pt  Pt2  1  0.00000000  -0.00000000  -0.00000000  1.0
  Pt  Pt3  1  0.00000000  0.50000000  -0.00000000  1.0
  Pt  Pt4  1  0.50000000  -0.00000000  -0.00000000  1.0
  Pt  Pt5  1  0.50000000  0.50000000  -0.00000000  1.0
  S  S6  1  0.83015156  0.16984844  0.19169458  1.0
  S  S7  1  0.83015156  0.66030311  0.19169458  1.0
  S  S8  1  0.33969689  0.16984844  0.19169458  1.0
  S  S9  1  0.66030311  0.83015156  0.80830542  1.0
  S  S10  1  0.16984844  0.83015156  0.80830542  1.0
  S  S11  1  0.16984844  0.33969689  0.80830542  1.0