# generated using pymatgen
data_Hf2Zr3Sn3S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.52040273
_cell_length_b   8.52040251
_cell_length_c   5.94169259
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999701
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hf2Zr3Sn3S
_chemical_formula_sum   'Hf4 Zr6 Sn6 S2'
_cell_volume   373.56059482
_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
  Hf  Hf0  1  0.66666700  0.33333300  0.00000000  1.0
  Hf  Hf1  1  0.33333300  0.66666700  0.00000000  1.0
  Hf  Hf2  1  0.33333300  0.66666700  0.50000000  1.0
  Hf  Hf3  1  0.66666700  0.33333300  0.50000000  1.0
  Zr  Zr4  1  0.74734938  0.74734938  0.75000000  1.0
  Zr  Zr5  1  0.25265062  1.00000000  0.75000000  1.0
  Zr  Zr6  1  1.00000000  0.25265062  0.75000000  1.0
  Zr  Zr7  1  0.25265062  0.25265062  0.25000000  1.0
  Zr  Zr8  1  0.74734938  0.00000000  0.25000000  1.0
  Zr  Zr9  1  0.00000000  0.74734938  0.25000000  1.0
  Sn  Sn10  1  0.40053380  0.40053380  0.75000000  1.0
  Sn  Sn11  1  0.59946620  0.00000000  0.75000000  1.0
  Sn  Sn12  1  0.00000000  0.59946620  0.75000000  1.0
  Sn  Sn13  1  0.59946620  0.59946620  0.25000000  1.0
  Sn  Sn14  1  0.40053380  1.00000000  0.25000000  1.0
  Sn  Sn15  1  1.00000000  0.40053380  0.25000000  1.0
  S  S16  1  0.00000000  0.00000000  0.00000000  1.0
  S  S17  1  0.00000000  0.00000000  0.50000000  1.0