# generated using pymatgen
data_Sm3Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.89327929
_cell_length_b   8.78119770
_cell_length_c   47.01764983
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   132.58200510
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3Al
_chemical_formula_sum   'Sm42 Al14'
_cell_volume   3615.57000387
_cell_formula_units_Z   14
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  0.804388  0.245369  0.277842  1
  Sm  Sm2  1  0.073051  0.124064  0.304815  1
  Sm  Sm3  1  0.423627  0.167600  0.275840  1
  Sm  Sm4  1  0.767740  0.545896  0.327260  1
  Sm  Sm5  1  0.690622  0.736835  0.267842  1
  Sm  Sm6  1  0.335455  0.683477  0.291440  1
  Sm  Sm7  1  0.269776  0.016612  0.346407  1
  Sm  Sm8  1  0.334686  0.596426  0.370457  1
  Sm  Sm9  1  0.710211  0.916456  0.344223  1
  Sm  Sm10  1  0.976052  0.976479  0.386335  1
  Sm  Sm11  1  1.000243  0.423899  0.345291  1
  Sm  Sm12  1  0.616042  0.142346  0.397911  1
  Sm  Sm13  1  0.570091  0.474456  0.392845  1
  Sm  Sm14  1  0.714493  0.128685  0.481918  1
  Sm  Sm15  1  0.993854  0.319926  0.424201  1
  Sm  Sm16  1  0.382430  0.642473  0.457247  1
  Sm  Sm17  1  0.233958  0.864696  0.411311  1
  Sm  Sm18  1  0.873773  0.571614  0.449923  1
  Sm  Sm19  1  0.082916  0.078445  0.469430  1
  Sm  Sm20  1  0.043834  0.761132  0.525276  1
  Sm  Sm21  1  0.433055  0.187894  0.466624  1
  Sm  Sm22  1  0.673101  0.423447  0.525932  1
  Sm  Sm23  1  0.712183  0.740759  0.470086  1
  Sm  Sm24  1  0.322962  0.313998  0.528738  1
  Sm  Sm25  1  0.373587  0.859418  0.538115  1
  Sm  Sm26  1  0.522059  0.637196  0.584051  1
  Sm  Sm27  1  0.882244  0.930278  0.545439  1
  Sm  Sm28  1  0.185926  0.027436  0.602517  1
  Sm  Sm29  1  0.041524  0.373206  0.513444  1
  Sm  Sm30  1  0.762163  0.181966  0.571161  1
  Sm  Sm31  1  0.779965  0.525413  0.609027  1
  Sm  Sm32  1  0.755774  0.077993  0.650071  1
  Sm  Sm33  1  0.139975  0.359545  0.597451  1
  Sm  Sm34  1  0.486241  0.485280  0.648955  1
  Sm  Sm35  1  0.421331  0.905466  0.624905  1
  Sm  Sm36  1  0.045806  0.585436  0.651139  1
  Sm  Sm37  1  0.988277  0.955996  0.668102  1
  Sm  Sm38  1  0.065395  0.765056  0.727520  1
  Sm  Sm39  1  0.420562  0.818415  0.703922  1
  Sm  Sm40  1  0.951629  0.256522  0.717520  1
  Sm  Sm41  1  0.682965  0.377828  0.690547  1
  Sm  Sm42  1  0.332390  0.334292  0.719522  1
  Al  Al43  1  0.074386  0.731181  0.294823  1
  Al  Al44  1  0.554900  0.073560  0.330082  1
  Al  Al45  1  0.454445  0.464491  0.322892  1
  Al  Al46  1  0.908624  0.582190  0.385918  1
  Al  Al47  1  0.668671  0.871847  0.414041  1
  Al  Al48  1  0.272224  0.282844  0.416727  1
  Al  Al49  1  0.174414  0.722584  0.472957  1
  Al  Al50  1  0.581603  0.779308  0.522405  1
  Al  Al51  1  0.483793  0.219047  0.578635  1
  Al  Al52  1  0.087346  0.630045  0.581321  1
  Al  Al53  1  0.847392  0.919702  0.609444  1
  Al  Al54  1  0.301571  0.037401  0.672470  1
  Al  Al55  1  0.201117  0.428332  0.665280  1
  Al  Al56  1  0.681630  0.770711  0.700539  1
