# generated using pymatgen
data_Pr12ThGa7Ru8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.82765087
_cell_length_b   8.01890129
_cell_length_c   14.07488885
_cell_angle_alpha   90.69030703
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pr12ThGa7Ru8
_chemical_formula_sum   'Pr12 Th1 Ga7 Ru8'
_cell_volume   657.69091911
_cell_formula_units_Z   1
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  0.13256776  0.88326557  0.60344281  1.0
  Pr  Pr1  1  0.84511341  0.09466951  0.09281776  1.0
  Pr  Pr2  1  0.13256776  0.61673443  0.39655719  1.0
  Pr  Pr3  1  0.84511341  0.40533049  0.90718224  1.0
  Pr  Pr4  1  0.85423169  0.08822173  0.39513239  1.0
  Pr  Pr5  1  0.15160009  0.90194336  0.90529522  1.0
  Pr  Pr6  1  0.85423169  0.41177827  0.60486761  1.0
  Pr  Pr7  1  0.15160009  0.59805664  0.09470478  1.0
  Pr  Pr8  1  0.37990817  0.25805547  0.76225670  1.0
  Pr  Pr9  1  0.62246284  0.73415059  0.24044725  1.0
  Pr  Pr10  1  0.37990817  0.24194453  0.23774330  1.0
  Pr  Pr11  1  0.62246284  0.76584941  0.75955275  1.0
  Th  Th12  1  0.37161828  0.25000000  0.50000000  1.0
  Ga  Ga13  1  0.86665997  0.10866833  0.75026835  1.0
  Ga  Ga14  1  0.14043006  0.89861059  0.24297190  1.0
  Ga  Ga15  1  0.86665997  0.39133167  0.24973165  1.0
  Ga  Ga16  1  0.14043006  0.60138941  0.75702810  1.0
  Ga  Ga17  1  0.61822158  0.75000000  0.00000000  1.0
  Ga  Ga18  1  0.61142432  0.75000000  0.50000000  1.0
  Ga  Ga19  1  0.38239096  0.25000000  0.00000000  1.0
  Ru  Ru20  1  0.65509660  0.02964657  0.59095082  1.0
  Ru  Ru21  1  0.35704360  0.97196529  0.08862849  1.0
  Ru  Ru22  1  0.65509660  0.47035343  0.40904918  1.0
  Ru  Ru23  1  0.35704360  0.52803471  0.91137151  1.0
  Ru  Ru24  1  0.35609034  0.96854553  0.40643493  1.0
  Ru  Ru25  1  0.64696841  0.03046685  0.90623663  1.0
  Ru  Ru26  1  0.35609034  0.53145447  0.59356507  1.0
  Ru  Ru27  1  0.64696841  0.46953315  0.09376337  1.0