# generated using pymatgen
data_CuAsPtS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.15793921
_cell_length_b   8.15793921
_cell_length_c   5.90373000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   152.95420597
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuAsPtS2
_chemical_formula_sum   'Cu2 As2 Pt2 S4'
_cell_volume   178.65482768
_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
  Cu  Cu0  1  0.94885500  0.05114500  0.23332300  1.0
  Cu  Cu1  1  0.05114500  0.94885500  0.73332300  1.0
  As  As2  1  0.73326000  0.26674000  0.63384000  1.0
  As  As3  1  0.26674000  0.73326000  0.13384000  1.0
  Pt  Pt4  1  0.67593100  0.32406900  0.24337700  1.0
  Pt  Pt5  1  0.32406900  0.67593100  0.74337700  1.0
  S  S6  1  0.91678300  0.08321700  0.85867800  1.0
  S  S7  1  0.08321700  0.91678300  0.35867800  1.0
  S  S8  1  0.61642000  0.38358000  0.86478200  1.0
  S  S9  1  0.38358000  0.61642000  0.36478200  1.0