# generated using pymatgen
data_GaBiS
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.78165500
_cell_length_b   8.61443748
_cell_length_c   8.61443748
_cell_angle_alpha   71.19564947
_cell_angle_beta   55.40667754
_cell_angle_gamma   55.40667754
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GaBiS
_chemical_formula_sum   'Ga4 Bi4 S4'
_cell_volume   491.90313850
_cell_formula_units_Z   4
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
  Ga  Ga0  1  0.25000000  0.00000000  0.50000000  1.0
  Ga  Ga1  1  0.75000000  0.00000000  0.50000000  1.0
  Ga  Ga2  1  0.25000000  0.50000000  0.00000000  1.0
  Ga  Ga3  1  0.75000000  0.50000000  0.00000000  1.0
  Bi  Bi4  1  0.88443400  0.50000000  0.23113200  1.0
  Bi  Bi5  1  0.61556600  0.50000000  0.76886800  1.0
  Bi  Bi6  1  0.38443400  0.23113200  0.50000000  1.0
  Bi  Bi7  1  0.11556600  0.76886800  0.50000000  1.0
  S  S8  1  0.89129500  0.21741000  0.50000000  1.0
  S  S9  1  0.60870500  0.78259000  0.50000000  1.0
  S  S10  1  0.10870500  0.50000000  0.78259000  1.0
  S  S11  1  0.39129500  0.50000000  0.21741000  1.0