# generated using pymatgen
data_Pr6BAsCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.15112896
_cell_length_b   10.15112850
_cell_length_c   10.00193651
_cell_angle_alpha   109.47545175
_cell_angle_beta   109.47544966
_cell_angle_gamma   110.05939940
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr6BAsCl6
_chemical_formula_sum   'Pr12 B2 As2 Cl12'
_cell_volume   787.48094369
_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
  Pr  Pr0  1  0.47774083  0.50035358  0.22895042  1.0
  Pr  Pr1  1  0.77140316  0.24878941  0.27104958  1.0
  Pr  Pr2  1  0.76825726  0.02215143  0.50256962  1.0
  Pr  Pr3  1  0.23431036  0.48041919  0.50256962  1.0
  Pr  Pr4  1  0.25121059  0.72859684  0.22895042  1.0
  Pr  Pr5  1  0.01958081  0.26568964  0.99743038  1.0
  Pr  Pr6  1  0.99964642  0.02225917  0.27104958  1.0
  Pr  Pr7  1  0.47784857  0.73174274  0.99743038  1.0
  Pr  Pr8  1  0.49743839  0.24743839  0.49487578  1.0
  Pr  Pr9  1  0.01532450  0.48467550  0.75000000  1.0
  Pr  Pr10  1  0.25256161  0.00256161  0.00512422  1.0
  Pr  Pr11  1  0.23467550  0.26532450  0.75000000  1.0
  B  B12  1  0.99859083  0.24859083  0.49718065  1.0
  B  B13  1  0.25140917  0.50140917  0.00281935  1.0
  As  As14  1  0.25057266  0.24942734  0.25000000  1.0
  As  As15  1  0.49942734  0.00057266  0.25000000  1.0
  Cl  Cl16  1  0.24705413  0.75260102  0.74326536  1.0
  Cl  Cl17  1  0.50933466  0.50378777  0.75673464  1.0
  Cl  Cl18  1  0.99882140  0.74860994  0.99858326  1.0
  Cl  Cl19  1  0.74739898  0.25294587  0.75673464  1.0
  Cl  Cl20  1  0.99621223  0.99066534  0.74326536  1.0
  Cl  Cl21  1  0.25002667  0.00024013  0.50141674  1.0
  Cl  Cl22  1  0.75139006  0.50117860  0.50141674  1.0
  Cl  Cl23  1  0.49975987  0.24997333  0.99858326  1.0
  Cl  Cl24  1  0.75159726  0.74840274  0.25000000  1.0
  Cl  Cl25  1  0.74838059  0.99838059  0.99676218  1.0
  Cl  Cl26  1  0.99840274  0.50159726  0.25000000  1.0
  Cl  Cl27  1  0.50161941  0.75161941  0.50323782  1.0