# generated using pymatgen
data_Sm3Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   24.76620195
_cell_length_b   8.75910081
_cell_length_c   48.32510217
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   57.19719417
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm3Al
_chemical_formula_sum   'Sm108 Al36'
_cell_volume   8811.50596855
_cell_formula_units_Z   36
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  0.048859  0.987406  0.245531  1
  Sm  Sm2  1  0.393399  0.691689  0.284410  1
  Sm  Sm3  1  0.776152  0.272746  0.325375  1
  Sm  Sm4  1  0.912301  0.391649  0.339973  1
  Sm  Sm5  1  0.215095  0.855746  0.258968  1
  Sm  Sm6  1  0.585508  0.461143  0.275174  1
  Sm  Sm7  1  0.874336  0.777058  0.279748  1
  Sm  Sm8  1  0.154088  0.599396  0.292200  1
  Sm  Sm9  1  0.669349  0.671421  0.281337  1
  Sm  Sm10  1  0.964194  0.973329  0.320834  1
  Sm  Sm11  1  0.344837  0.361066  0.277597  1
  Sm  Sm12  1  0.692163  0.040845  0.305293  1
  Sm  Sm13  1  0.277134  0.123574  0.264962  1
  Sm  Sm14  1  0.516063  0.179377  0.280694  1
  Sm  Sm15  1  0.849827  0.838639  0.355814  1
  Sm  Sm16  1  0.086836  0.360815  0.254703  1
  Sm  Sm17  1  0.467391  0.892168  0.309387  1
  Sm  Sm18  1  0.865628  0.272522  0.263029  1
  Sm  Sm19  1  0.026375  0.522010  0.324706  1
  Sm  Sm20  1  0.298357  0.235532  0.340491  1
  Sm  Sm21  1  0.604630  0.965445  0.397258  1
  Sm  Sm22  1  0.748345  0.992051  0.420520  1
  Sm  Sm23  1  0.198333  0.146147  0.373852  1
  Sm  Sm24  1  0.453291  0.131065  0.364862  1
  Sm  Sm25  1  0.863930  0.168447  0.390238  1
  Sm  Sm26  1  0.142480  0.917301  0.413915  1
  Sm  Sm27  1  0.531392  0.379188  0.343497  1
  Sm  Sm28  1  0.868466  0.525707  0.411701  1
  Sm  Sm29  1  0.251975  0.771914  0.330527  1
  Sm  Sm30  1  0.607853  0.589984  0.346549  1
  Sm  Sm31  1  0.089681  0.058868  0.326168  1
  Sm  Sm32  1  0.381570  0.784862  0.367060  1
  Sm  Sm33  1  0.700240  0.443222  0.403016  1
  Sm  Sm34  1  0.128281  0.625275  0.362697  1
  Sm  Sm35  1  0.318016  0.531684  0.391179  1
  Sm  Sm36  1  0.737183  0.693836  0.361225  1
  Sm  Sm37  1  0.917265  0.773197  0.439482  1
  Sm  Sm38  1  0.262586  0.544003  0.461509  1
  Sm  Sm39  1  0.504992  0.671877  0.481511  1
  Sm  Sm40  1  0.678431  0.378796  0.483900  1
  Sm  Sm41  1  0.066897  0.713982  0.438512  1
  Sm  Sm42  1  0.401216  0.600455  0.454005  1
  Sm  Sm43  1  0.752378  0.611014  0.452494  1
  Sm  Sm44  1  0.042894  0.325066  0.475973  1
  Sm  Sm45  1  0.498365  0.772434  0.403226  1
  Sm  Sm46  1  0.787984  0.894172  0.488786  1
  Sm  Sm47  1  0.170466  0.277043  0.442101  1
  Sm  Sm48  1  0.475284  0.151632  0.446180  1
  Sm  Sm49  1  0.030367  0.387808  0.395459  1
  Sm  Sm50  1  0.342698  0.085933  0.432183  1
  Sm  Sm51  1  0.619424  0.093212  0.476037  1
  Sm  Sm52  1  0.958660  0.141422  0.446756  1
  Sm  Sm53  1  0.232226  0.944758  0.488525  1
  Sm  Sm54  1  0.585205  0.355423  0.420242  1
  Sm  Sm55  1  0.836748  0.281869  0.504569  1
  Sm  Sm56  1  0.149448  0.024409  0.547176  1
  Sm  Sm57  1  0.454266  0.898997  0.551254  1
  Sm  Sm58  1  0.594365  0.788233  0.597897  1
  Sm  Sm59  1  0.005308  0.082829  0.517319  1
  Sm  Sm60  1  0.282034  0.090108  0.561172  1
  Sm  Sm61  1  0.666072  0.034618  0.546599  1
  Sm  Sm62  1  0.039527  0.820618  0.573114  1
  Sm  Sm63  1  0.392506  0.231282  0.504831  1
  Sm  Sm64  1  0.707467  0.402844  0.553874  1
  Sm  Sm65  1  0.119740  0.504164  0.511845  1
  Sm  Sm66  1  0.362146  0.632038  0.531847  1
  Sm  Sm67  1  0.946301  0.797245  0.509456  1
  Sm  Sm68  1  0.223516  0.575585  0.539351  1
  Sm  Sm69  1  0.557835  0.462059  0.554844  1
  Sm  Sm70  1  0.872354  0.565027  0.540862  1
  Sm  Sm71  1  0.126367  0.403607  0.590129  1
  Sm  Sm72  1  0.581838  0.850974  0.517383  1
  Sm  Sm73  1  0.756266  0.650333  0.581655  1
  Sm  Sm74  1  0.016879  0.586056  0.646807  1
  Sm  Sm75  1  0.372757  0.404127  0.662829  1
  Sm  Sm76  1  0.535051  0.117173  0.667188  1
  Sm  Sm77  1  0.924492  0.732819  0.590340  1
  Sm  Sm78  1  0.243162  0.391179  0.626296  1
  Sm  Sm79  1  0.496451  0.550766  0.630659  1
  Sm  Sm80  1  0.887549  0.482205  0.632131  1
  Sm  Sm81  1  0.306716  0.644356  0.602176  1
  Sm  Sm82  1  0.598357  0.654031  0.668650  1
  Sm  Sm83  1  0.020102  0.210596  0.596098  1
  Sm  Sm84  1  0.326375  0.940509  0.652865  1
  Sm  Sm85  1  0.876387  0.183989  0.572836  1
  Sm  Sm86  1  0.171441  0.044976  0.628493  1
  Sm  Sm87  1  0.426399  0.029894  0.619504  1
  Sm  Sm88  1  0.760802  0.007594  0.603118  1
  Sm  Sm89  1  0.093340  0.796853  0.649859  1
  Sm  Sm90  1  0.482252  0.258740  0.579441  1
  Sm  Sm91  1  0.660538  0.202712  0.672521  1
  Sm  Sm92  1  0.932569  0.135196  0.688063  1
  Sm  Sm93  1  0.279895  0.814974  0.715758  1
  Sm  Sm94  1  0.347598  0.052466  0.728394  1
  Sm  Sm95  1  0.774905  0.337401  0.637542  1
  Sm  Sm96  1  0.108669  0.996664  0.712661  1
  Sm  Sm97  1  0.537896  0.815225  0.738653  1
  Sm  Sm98  1  0.759104  0.903519  0.730327  1
  Sm  Sm99  1  0.157341  0.283873  0.683969  1
  Sm  Sm100  1  0.575873  0.188635  0.747825  1
  Sm  Sm101  1  0.848580  0.903295  0.667980  1
  Sm  Sm102  1  0.231333  0.484352  0.708946  1
  Sm  Sm103  1  0.712430  0.784392  0.653383  1
  Sm  Sm104  1  0.039224  0.714898  0.718182  1
  Sm  Sm105  1  0.409637  0.320294  0.734387  1
  Sm  Sm106  1  0.750396  0.398982  0.713607  1
  Sm  Sm107  1  0.955383  0.504620  0.712019  1
  Sm  Sm108  1  0.470644  0.576645  0.701156  1
  Al  Al109  1  0.977435  0.327976  0.283789  1
  Al  Al110  1  0.175639  0.210626  0.309922  1
  Al  Al111  1  0.745251  0.217270  0.266351  1
  Al  Al112  1  0.999942  0.763077  0.268449  1
  Al  Al113  1  0.393790  0.453927  0.330058  1
  Al  Al114  1  0.795825  0.620079  0.303203  1
  Al  Al115  1  0.984067  0.785325  0.381369  1
  Al  Al116  1  0.221879  0.444836  0.407120  1
  Al  Al117  1  0.590786  0.958625  0.332396  1
  Al  Al118  1  0.010190  0.058631  0.381907  1
  Al  Al119  1  0.274542  0.874261  0.424451  1
  Al  Al120  1  0.682703  0.151240  0.365188  1
  Al  Al121  1  0.811496  0.179064  0.449116  1
  Al  Al122  1  0.125933  0.856996  0.482342  1
  Al  Al123  1  0.461996  0.415236  0.397786  1
  Al  Al124  1  0.897357  0.499386  0.479312  1
  Al  Al125  1  0.260981  0.253540  0.494370  1
  Al  Al126  1  0.602968  0.747734  0.450578  1
  Al  Al127  1  0.727375  0.676655  0.514044  1
  Al  Al128  1  0.021764  0.428307  0.542778  1
  Al  Al129  1  0.363751  0.922501  0.498985  1
  Al  Al130  1  0.813236  0.996977  0.544240  1
  Al  Al131  1  0.162736  0.760804  0.595570  1
  Al  Al132  1  0.498799  0.319044  0.511013  1
  Al  Al133  1  0.614541  0.117409  0.611449  1
  Al  Al134  1  0.942029  0.024801  0.628168  1
  Al  Al135  1  0.350190  0.301779  0.568905  1
  Al  Al136  1  0.640665  0.390716  0.611987  1
  Al  Al137  1  0.033946  0.217415  0.660960  1
  Al  Al138  1  0.402853  0.731204  0.586236  1
  Al  Al139  1  0.624790  0.412964  0.724907  1
  Al  Al140  1  0.828907  0.555961  0.690152  1
  Al  Al141  1  0.230942  0.722114  0.663298  1
  Al  Al142  1  0.647297  0.848064  0.709567  1
  Al  Al143  1  0.879481  0.958770  0.727004  1
  Al  Al144  1  0.449093  0.965414  0.683434  1
