# generated using pymatgen
data_CsPa3S4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.96936731
_cell_length_b   3.96936776
_cell_length_c   28.66379439
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999629
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CsPa3S4
_chemical_formula_sum   'Cs2 Pa6 S8'
_cell_volume   391.11723565
_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
  Cs  Cs0  1  0.66666700  0.33333300  0.25000000  1.0
  Cs  Cs1  1  0.33333300  0.66666700  0.75000000  1.0
  Pa  Pa2  1  0.66666700  0.33333300  0.60492789  1.0
  Pa  Pa3  1  0.66666700  0.33333300  0.89507211  1.0
  Pa  Pa4  1  0.33333300  0.66666700  0.39507211  1.0
  Pa  Pa5  1  0.33333300  0.66666700  0.10492789  1.0
  Pa  Pa6  1  0.00000000  0.00000000  0.50000000  1.0
  Pa  Pa7  1  0.00000000  0.00000000  0.00000000  1.0
  S  S8  1  0.00000000  0.00000000  0.16015918  1.0
  S  S9  1  0.66666700  0.33333300  0.44694535  1.0
  S  S10  1  0.00000000  0.00000000  0.66015918  1.0
  S  S11  1  0.33333300  0.66666700  0.94694535  1.0
  S  S12  1  0.33333300  0.66666700  0.55305465  1.0
  S  S13  1  0.00000000  0.00000000  0.33984082  1.0
  S  S14  1  0.66666700  0.33333300  0.05305465  1.0
  S  S15  1  0.00000000  0.00000000  0.83984082  1.0