# generated using pymatgen
data_Sm3Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86985814
_cell_length_b   23.64690440
_cell_length_c   67.80889355
_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   'Sm90 Al30'
_cell_volume   7808.67349715
_cell_formula_units_Z   30
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  0.316026  0.762998  0.211926  1
  Sm  Sm2  1  0.316026  0.464968  0.180626  1
  Sm  Sm3  1  0.316026  0.042286  0.248568  1
  Sm  Sm4  1  0.316026  0.905183  0.226905  1
  Sm  Sm5  1  0.316026  0.617079  0.196096  1
  Sm  Sm6  1  0.316026  0.301583  0.168813  1
  Sm  Sm7  1  0.316026  1.000844  0.173885  1
  Sm  Sm8  1  0.316026  0.515691  0.235809  1
  Sm  Sm9  1  0.316026  0.237971  0.217503  1
  Sm  Sm10  1  0.816026  0.871372  0.185813  1
  Sm  Sm11  1  0.816026  0.559376  0.157685  1
  Sm  Sm12  1  0.816026  0.143364  0.230614  1
  Sm  Sm13  1  0.816026  0.713247  0.174278  1
  Sm  Sm14  1  0.816026  0.282218  0.249510  1
  Sm  Sm15  1  0.816026  1.008303  0.211400  1
  Sm  Sm16  1  0.816026  0.664594  0.235456  1
  Sm  Sm17  1  0.816026  0.389516  0.207925  1
  Sm  Sm18  1  0.816026  0.145920  0.176558  1
  Sm  Sm19  1  0.316026  0.595172  0.315059  1
  Sm  Sm20  1  0.316026  0.317917  0.284235  1
  Sm  Sm21  1  0.316026  0.868247  0.347388  1
  Sm  Sm22  1  0.316026  0.734400  0.328568  1
  Sm  Sm23  1  0.316026  0.458699  0.298578  1
  Sm  Sm24  1  0.316026  0.178895  0.269281  1
  Sm  Sm25  1  0.316026  0.793385  0.265567  1
  Sm  Sm26  1  0.316026  0.343968  0.337279  1
  Sm  Sm27  1  0.316026  0.064202  0.303669  1
  Sm  Sm28  1  0.816026  0.695703  0.289329  1
  Sm  Sm29  1  0.816026  0.422245  0.260617  1
  Sm  Sm30  1  0.816026  0.968095  0.323907  1
  Sm  Sm31  1  0.816026  0.556239  0.277139  1
  Sm  Sm32  1  0.816026  0.101991  0.344808  1
  Sm  Sm33  1  0.816026  0.829881  0.307748  1
  Sm  Sm34  1  0.816026  0.494565  0.338399  1
  Sm  Sm35  1  0.816026  0.217293  0.306561  1
  Sm  Sm36  1  0.816026  0.941594  0.268958  1
  Sm  Sm37  1  0.316026  0.417100  0.415594  1
  Sm  Sm38  1  0.316026  0.140914  0.383479  1
  Sm  Sm39  1  0.316026  0.694301  0.447576  1
  Sm  Sm40  1  0.316026  0.557965  0.429266  1
  Sm  Sm41  1  0.316026  0.281028  0.397873  1
  Sm  Sm42  1  0.316026  1.005938  0.363868  1
  Sm  Sm43  1  0.316026  0.620397  0.368177  1
  Sm  Sm44  1  0.316026  0.167589  0.436678  1
  Sm  Sm45  1  0.316026  0.894093  0.401722  1
  Sm  Sm46  1  0.816026  0.519807  0.391130  1
  Sm  Sm47  1  0.816026  0.242607  0.359148  1
  Sm  Sm48  1  0.816026  0.795993  0.423245  1
  Sm  Sm49  1  0.816026  0.378942  0.377458  1
  Sm  Sm50  1  0.816026  0.930969  0.442856  1
  Sm  Sm51  1  0.816026  0.655879  0.408851  1
  Sm  Sm52  1  0.816026  0.316510  0.438547  1
  Sm  Sm53  1  0.816026  0.042814  0.405002  1
  Sm  Sm54  1  0.816026  0.769318  0.370046  1
  Sm  Sm55  1  0.316026  0.241204  0.517395  1
  Sm  Sm56  1  0.316026  0.968812  0.482817  1
  Sm  Sm57  1  0.316026  0.514662  0.546107  1
  Sm  Sm58  1  0.316026  0.380668  0.529585  1
  Sm  Sm59  1  0.316026  0.107026  0.498976  1
  Sm  Sm60  1  0.316026  0.834916  0.461916  1
  Sm  Sm61  1  0.316026  0.442342  0.468325  1
  Sm  Sm62  1  0.316026  0.995313  0.537766  1
  Sm  Sm63  1  0.316026  0.719614  0.500163  1
  Sm  Sm64  1  0.816026  0.341735  0.491665  1
  Sm  Sm65  1  0.816026  0.068661  0.459336  1
  Sm  Sm66  1  0.816026  0.618990  0.522489  1
  Sm  Sm67  1  0.816026  0.202507  0.478156  1
  Sm  Sm68  1  0.816026  0.758012  0.537443  1
  Sm  Sm69  1  0.816026  0.478208  0.508146  1
  Sm  Sm70  1  0.816026  0.143522  0.541157  1
  Sm  Sm71  1  0.816026  0.872705  0.503055  1
  Sm  Sm72  1  0.816026  0.592939  0.469445  1
  Sm  Sm73  1  0.316026  0.065535  0.620911  1
  Sm  Sm74  1  0.316026  0.793543  0.576110  1
  Sm  Sm75  1  0.316026  0.377531  0.649039  1
  Sm  Sm76  1  0.316026  0.223660  0.632446  1
  Sm  Sm77  1  0.316026  0.928604  0.595324  1
  Sm  Sm78  1  0.316026  0.654689  0.557214  1
  Sm  Sm79  1  0.316026  0.272313  0.571268  1
  Sm  Sm80  1  0.316026  0.790987  0.630166  1
  Sm  Sm81  1  0.316026  0.547391  0.598799  1
  Sm  Sm82  1  0.816026  0.173909  0.594798  1
  Sm  Sm83  1  0.816026  0.894621  0.558156  1
  Sm  Sm84  1  0.816026  0.471939  0.626098  1
  Sm  Sm85  1  0.816026  0.031724  0.579819  1
  Sm  Sm86  1  0.816026  0.635324  0.637911  1
  Sm  Sm87  1  0.816026  0.319828  0.610628  1
  Sm  Sm88  1  0.816026  0.936063  0.632839  1
  Sm  Sm89  1  0.816026  0.698936  0.589221  1
  Sm  Sm90  1  0.816026  0.421216  0.570915  1
  Al  Al91  1  0.816026  0.819603  0.234918  1
  Al  Al92  1  0.816026  0.532475  0.205390  1
  Al  Al93  1  0.816026  0.265633  0.195120  1
  Al  Al94  1  0.316026  0.800687  0.168683  1
  Al  Al95  1  0.316026  0.368178  0.237181  1
  Al  Al96  1  0.316026  0.102988  0.204394  1
  Al  Al97  1  0.816026  0.650086  0.338892  1
  Al  Al98  1  0.816026  0.372591  0.308136  1
  Al  Al99  1  0.816026  0.090074  0.275226  1
  Al  Al100  1  0.316026  0.639683  0.265506  1
  Al  Al101  1  0.316026  0.185655  0.334940  1
  Al  Al102  1  0.316026  0.916027  0.298715  1
  Al  Al103  1  0.816026  0.472834  0.439425  1
  Al  Al104  1  0.816026  0.195608  0.407614  1
  Al  Al105  1  0.816026  0.920373  0.372286  1
  Al  Al106  1  0.316026  0.464073  0.367299  1
  Al  Al107  1  0.316026  1.016534  0.434438  1
  Al  Al108  1  0.316026  0.741299  0.399110  1
  Al  Al109  1  0.816026  0.297224  0.541218  1
  Al  Al110  1  0.816026  1.020880  0.508009  1
  Al  Al111  1  0.816026  0.751252  0.471784  1
  Al  Al112  1  0.316026  0.286822  0.467832  1
  Al  Al113  1  0.316026  0.846833  0.531498  1
  Al  Al114  1  0.316026  0.564316  0.498588  1
  Al  Al115  1  0.816026  0.136220  0.638041  1
  Al  Al116  1  0.816026  0.833919  0.602330  1
  Al  Al117  1  0.816026  0.568729  0.569543  1
  Al  Al118  1  0.316026  0.117304  0.571806  1
  Al  Al119  1  0.316026  0.671274  0.611604  1
  Al  Al120  1  0.316026  0.404432  0.601335  1
