# generated using pymatgen
data_BaPr2MnS5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.90016398
_cell_length_b   8.90016398
_cell_length_c   8.90016398
_cell_angle_alpha   126.80394977
_cell_angle_beta   126.80394977
_cell_angle_gamma   78.57075924
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaPr2MnS5
_chemical_formula_sum   'Ba2 Pr4 Mn2 S10'
_cell_volume   437.54731190
_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  0.75000000  0.75000000  0.00000000  1.0
  Ba  Ba1  1  0.25000000  0.25000000  0.00000000  1.0
  Pr  Pr2  1  0.83809700  0.66190300  0.50000000  1.0
  Pr  Pr3  1  0.66190300  0.16190300  0.82380700  1.0
  Pr  Pr4  1  0.33809700  0.83809700  0.17619300  1.0
  Pr  Pr5  1  0.16190300  0.33809700  0.50000000  1.0
  Mn  Mn6  1  0.25000000  0.75000000  0.50000000  1.0
  Mn  Mn7  1  0.75000000  0.25000000  0.50000000  1.0
  S  S8  1  0.98390100  0.48390100  0.19980200  1.0
  S  S9  1  0.71590100  0.21590100  0.19980200  1.0
  S  S10  1  0.01609900  0.51609900  0.80019800  1.0
  S  S11  1  0.51609900  0.71590100  0.50000000  1.0
  S  S12  1  0.21590100  0.01609900  0.50000000  1.0
  S  S13  1  0.48390100  0.28409900  0.50000000  1.0
  S  S14  1  0.78409900  0.98390100  0.50000000  1.0
  S  S15  1  0.28409900  0.78409900  0.80019800  1.0
  S  S16  1  0.00000000  0.00000000  0.00000000  1.0
  S  S17  1  0.50000000  0.50000000  0.00000000  1.0