# generated using pymatgen
data_As2S
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54712513
_cell_length_b   5.54712513
_cell_length_c   5.54712513
_cell_angle_alpha   101.58575450
_cell_angle_beta   101.58575450
_cell_angle_gamma   126.75047732
_symmetry_Int_Tables_number   1
_chemical_formula_structural   As2S
_chemical_formula_sum   'As4 S2'
_cell_volume   122.26149368
_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
  As  As0  1  0.12500000  0.87500000  0.25000000  1.0
  As  As1  1  0.62500000  0.87500000  0.75000000  1.0
  As  As2  1  0.12500000  0.37500000  0.25000000  1.0
  As  As3  1  0.12500000  0.87500000  0.75000000  1.0
  S  S4  1  0.75000000  0.25000000  0.50000000  1.0
  S  S5  1  0.50000000  0.50000000  0.00000000  1.0