# generated using pymatgen
data_Ba5As3SO12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.81492270
_cell_length_b   10.81492270
_cell_length_c   7.85372500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000428
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba5As3SO12
_chemical_formula_sum   'Ba10 As6 S2 O24'
_cell_volume   795.52373661
_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
  Ba  Ba0  1  0.33333300  0.66666700  0.49887900  1.0
  Ba  Ba1  1  0.66666700  0.33333300  0.50112100  1.0
  Ba  Ba2  1  0.66666700  0.33333300  0.99887900  1.0
  Ba  Ba3  1  0.33333300  0.66666700  0.00112100  1.0
  Ba  Ba4  1  0.25457900  0.24780900  0.75000000  1.0
  Ba  Ba5  1  0.74542100  0.75219100  0.25000000  1.0
  Ba  Ba6  1  0.75219100  0.00677000  0.75000000  1.0
  Ba  Ba7  1  0.24780900  0.99323000  0.25000000  1.0
  Ba  Ba8  1  0.99323000  0.74542100  0.75000000  1.0
  Ba  Ba9  1  0.00677000  0.25457900  0.25000000  1.0
  As  As10  1  0.03331400  0.41037300  0.75000000  1.0
  As  As11  1  0.96668600  0.58962700  0.25000000  1.0
  As  As12  1  0.58962700  0.62294100  0.75000000  1.0
  As  As13  1  0.41037300  0.37705900  0.25000000  1.0
  As  As14  1  0.37705900  0.96668600  0.75000000  1.0
  As  As15  1  0.62294100  0.03331400  0.25000000  1.0
  S  S16  1  0.00000000  0.00000000  0.50000000  1.0
  S  S17  1  0.00000000  0.00000000  0.00000000  1.0
  O  O18  1  0.09067600  0.35875900  0.57257500  1.0
  O  O19  1  0.90932400  0.64124100  0.42742500  1.0
  O  O20  1  0.64124100  0.73191700  0.57257500  1.0
  O  O21  1  0.90932400  0.64124100  0.07257500  1.0
  O  O22  1  0.35875900  0.26808300  0.42742500  1.0
  O  O23  1  0.09067600  0.35875900  0.92742500  1.0
  O  O24  1  0.26808300  0.90932400  0.57257500  1.0
  O  O25  1  0.35875900  0.26808300  0.07257500  1.0
  O  O26  1  0.73191700  0.09067600  0.42742500  1.0
  O  O27  1  0.64124100  0.73191700  0.92742500  1.0
  O  O28  1  0.73191700  0.09067600  0.07257500  1.0
  O  O29  1  0.26808300  0.90932400  0.92742500  1.0
  O  O30  1  0.49003900  0.14953900  0.75000000  1.0
  O  O31  1  0.50996100  0.85046100  0.25000000  1.0
  O  O32  1  0.85046100  0.34050000  0.75000000  1.0
  O  O33  1  0.14953900  0.65950000  0.25000000  1.0
  O  O34  1  0.65950000  0.50996100  0.75000000  1.0
  O  O35  1  0.34050000  0.49003900  0.25000000  1.0
  O  O36  1  0.12414600  0.59580000  0.75000000  1.0
  O  O37  1  0.87585400  0.40420000  0.25000000  1.0
  O  O38  1  0.40420000  0.52834600  0.75000000  1.0
  O  O39  1  0.59580000  0.47165400  0.25000000  1.0
  O  O40  1  0.47165400  0.87585400  0.75000000  1.0
  O  O41  1  0.52834600  0.12414600  0.25000000  1.0