# generated using pymatgen
data_Sm3Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.69039154
_cell_length_b   13.08501230
_cell_length_c   48.30973488
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3Al
_chemical_formula_sum   'Sm48 Al16'
_cell_volume   4229.22045115
_cell_formula_units_Z   16
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  0.844856  0.670529  0.318167  1
  Sm  Sm2  1  0.573297  0.222855  0.253155  1
  Sm  Sm3  1  0.343851  0.786377  0.311792  1
  Sm  Sm4  1  0.081883  0.075034  0.247847  1
  Sm  Sm5  1  0.597796  0.933027  0.261297  1
  Sm  Sm6  1  0.042750  0.424745  0.340569  1
  Sm  Sm7  1  0.849900  0.152965  0.317625  1
  Sm  Sm8  1  0.326479  0.519056  0.275005  1
  Sm  Sm9  1  0.346389  0.086556  0.313630  1
  Sm  Sm10  1  0.834812  0.456007  0.266461  1
  Sm  Sm11  1  0.085056  0.764362  0.248427  1
  Sm  Sm12  1  0.548039  0.350860  0.328857  1
  Sm  Sm13  1  0.846235  0.851270  0.444214  1
  Sm  Sm14  1  0.203447  0.202743  0.374731  1
  Sm  Sm15  1  0.349450  0.924238  0.432008  1
  Sm  Sm16  1  0.744432  0.288262  0.408647  1
  Sm  Sm17  1  0.615270  0.059458  0.383179  1
  Sm  Sm18  1  0.900430  0.554021  0.443158  1
  Sm  Sm19  1  0.655133  0.107933  0.470122  1
  Sm  Sm20  1  0.115772  0.668616  0.390143  1
  Sm  Sm21  1  0.243730  0.244251  0.446200  1
  Sm  Sm22  1  0.610451  0.772531  0.379220  1
  Sm  Sm23  1  0.092533  0.925675  0.365991  1
  Sm  Sm24  1  0.563367  0.507626  0.389720  1
  Sm  Sm25  1  0.915771  0.915932  0.542496  1
  Sm  Sm26  1  0.376409  0.476615  0.462517  1
  Sm  Sm27  1  0.421091  0.812018  0.553419  1
  Sm  Sm28  1  0.787813  0.340297  0.486439  1
  Sm  Sm29  1  0.468176  0.076922  0.542919  1
  Sm  Sm30  1  0.939009  0.658873  0.566648  1
  Sm  Sm31  1  0.828095  0.381805  0.557908  1
  Sm  Sm32  1  0.185308  0.733278  0.488425  1
  Sm  Sm33  1  0.287111  0.296286  0.523993  1
  Sm  Sm34  1  0.682093  0.660310  0.500631  1
  Sm  Sm35  1  0.131113  0.030527  0.489481  1
  Sm  Sm36  1  0.416273  0.525090  0.549461  1
  Sm  Sm37  1  0.705063  0.065492  0.657634  1
  Sm  Sm38  1  0.181642  0.431583  0.615015  1
  Sm  Sm39  1  0.196730  0.128541  0.666179  1
  Sm  Sm40  1  0.685154  0.497992  0.619009  1
  Sm  Sm41  1  0.483503  0.233688  0.603782  1
  Sm  Sm42  1  0.946487  0.820186  0.684212  1
  Sm  Sm43  1  0.458246  0.361693  0.679484  1
  Sm  Sm44  1  0.186687  0.914020  0.614472  1
  Sm  Sm45  1  0.949660  0.509514  0.684792  1
  Sm  Sm46  1  0.687692  0.798171  0.620848  1
  Sm  Sm47  1  0.988792  0.159803  0.592071  1
  Sm  Sm48  1  0.433746  0.651521  0.671342  1
  Al  Al49  1  0.619656  0.694741  0.262139  1
  Al  Al50  1  0.165255  0.287268  0.285359  1
  Al  Al51  1  1.002213  0.924873  0.297430  1
  Al  Al52  1  0.379681  0.584954  0.337620  1
  Al  Al53  1  0.679701  0.925434  0.330246  1
  Al  Al54  1  0.142469  0.420753  0.403522  1
  Al  Al55  1  0.984324  0.069270  0.421913  1
  Al  Al56  1  0.473385  0.687850  0.437767  1
  Al  Al57  1  0.558157  0.896698  0.494872  1
  Al  Al58  1  0.047218  0.515278  0.510726  1
  Al  Al59  1  0.889074  0.163796  0.529118  1
  Al  Al60  1  0.351842  0.659114  0.602393  1
  Al  Al61  1  0.651862  0.999594  0.595019  1
  Al  Al62  1  0.029329  0.659675  0.635210  1
  Al  Al63  1  0.866288  0.297281  0.647280  1
  Al  Al64  1  0.411887  0.889808  0.670500  1
