# generated using pymatgen
data_ScPa(Al3Rh)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.50427492
_cell_length_b   7.52714011
_cell_length_c   9.21997623
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.70737460
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScPa(Al3Rh)3
_chemical_formula_sum   'Sc2 Pa2 Al18 Rh6'
_cell_volume   452.34753787
_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
  Sc  Sc0  1  0.66974595  0.99066407  0.25000000  1.0
  Sc  Sc1  1  0.33025405  0.00933593  0.75000000  1.0
  Pa  Pa2  1  0.99686740  0.67071302  0.25000000  1.0
  Pa  Pa3  1  0.00313260  0.32928698  0.75000000  1.0
  Al  Al4  1  0.12961920  0.12491488  0.25000000  1.0
  Al  Al5  1  0.87038080  0.87508512  0.75000000  1.0
  Al  Al6  1  0.99741638  0.32772464  0.08106819  1.0
  Al  Al7  1  0.00258362  0.67227536  0.91893181  1.0
  Al  Al8  1  0.00258362  0.67227536  0.58106819  1.0
  Al  Al9  1  0.34091224  0.00261644  0.42680904  1.0
  Al  Al10  1  0.99741638  0.32772464  0.41893181  1.0
  Al  Al11  1  0.65908776  0.99738356  0.57319096  1.0
  Al  Al12  1  0.65908776  0.99738356  0.92680904  1.0
  Al  Al13  1  0.34091224  0.00261644  0.07319096  1.0
  Al  Al14  1  0.33487908  0.33101080  0.55106948  1.0
  Al  Al15  1  0.66512092  0.66898920  0.44893052  1.0
  Al  Al16  1  0.66512092  0.66898920  0.05106948  1.0
  Al  Al17  1  0.33487908  0.33101080  0.94893052  1.0
  Al  Al18  1  0.34439236  0.55156066  0.25000000  1.0
  Al  Al19  1  0.65560764  0.44843934  0.75000000  1.0
  Al  Al20  1  0.54995333  0.33844566  0.25000000  1.0
  Al  Al21  1  0.45004667  0.66155434  0.75000000  1.0
  Rh  Rh22  1  0.67658415  0.32987945  0.99946836  1.0
  Rh  Rh23  1  0.32341585  0.67012055  0.00053164  1.0
  Rh  Rh24  1  0.32341585  0.67012055  0.49946836  1.0
  Rh  Rh25  1  0.67658415  0.32987945  0.50053164  1.0
  Rh  Rh26  1  0.00000000  0.00000000  0.00000000  1.0
  Rh  Rh27  1  0.00000000  0.00000000  0.50000000  1.0