# generated using pymatgen
data_SmAl3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.33711251
_cell_length_b   6.33711251
_cell_length_c   51.49367835
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmAl3
_chemical_formula_sum   'Sm10 Al30'
_cell_volume   1790.88369602
_cell_formula_units_Z   10
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
  Sm  Sm1  1  0.335230  0.337128  0.291771  1
  Sm  Sm2  1  0.668564  0.670461  0.337576  1
  Sm  Sm3  1  0.335230  0.337128  0.381751  1
  Sm  Sm4  1  0.668564  0.670461  0.427531  1
  Sm  Sm5  1  0.335230  0.337128  0.472988  1
  Sm  Sm6  1  0.668564  0.670461  0.518229  1
  Sm  Sm7  1  0.335230  0.337128  0.563686  1
  Sm  Sm8  1  0.668564  0.670461  0.609466  1
  Sm  Sm9  1  0.335230  0.337128  0.653642  1
  Sm  Sm10  1  0.668564  0.670461  0.699447  1
  Al  Al11  1  0.150264  0.152161  0.336367  1
  Al  Al12  1  0.310588  0.849449  0.290510  1
  Al  Al13  1  0.847552  0.312485  0.290510  1
  Al  Al14  1  0.847552  0.849449  0.290510  1
  Al  Al15  1  0.705163  0.152161  0.336367  1
  Al  Al16  1  0.150264  0.707060  0.336367  1
  Al  Al17  1  0.152756  0.154653  0.427493  1
  Al  Al18  1  0.300455  0.854515  0.382268  1
  Al  Al19  1  0.852618  0.302352  0.382268  1
  Al  Al20  1  0.852618  0.854515  0.382268  1
  Al  Al21  1  0.700180  0.154653  0.427493  1
  Al  Al22  1  0.152756  0.702077  0.427493  1
  Al  Al23  1  0.151911  0.153808  0.518348  1
  Al  Al24  1  0.301924  0.853780  0.472869  1
  Al  Al25  1  0.851883  0.303822  0.472869  1
  Al  Al26  1  0.851883  0.853780  0.472869  1
  Al  Al27  1  0.701870  0.153808  0.518348  1
  Al  Al28  1  0.151911  0.703767  0.518348  1
  Al  Al29  1  0.151176  0.153073  0.608949  1
  Al  Al30  1  0.303614  0.852936  0.563725  1
  Al  Al31  1  0.851039  0.305511  0.563725  1
  Al  Al32  1  0.851039  0.852936  0.563725  1
  Al  Al33  1  0.703339  0.153073  0.608949  1
  Al  Al34  1  0.151176  0.705236  0.608949  1
  Al  Al35  1  0.156242  0.158139  0.700708  1
  Al  Al36  1  0.298631  0.855427  0.654850  1
  Al  Al37  1  0.853530  0.300528  0.654850  1
  Al  Al38  1  0.853530  0.855427  0.654850  1
  Al  Al39  1  0.693207  0.158139  0.700708  1
  Al  Al40  1  0.156242  0.695104  0.700708  1
