# generated using pymatgen
data_SmAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.32445171
_cell_length_b   20.23540585
_cell_length_c   58.19781443
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmAl
_chemical_formula_sum   'Sm120 Al120'
_cell_volume   13336.3129744
_cell_formula_units_Z   120
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  0.511358  0.604577  0.274266  1
  Sm  Sm2  1  0.518433  0.223857  0.303100  1
  Sm  Sm3  1  0.492684  0.977409  0.242564  1
  Sm  Sm4  1  0.181555  0.564844  0.259212  1
  Sm  Sm5  1  0.191990  0.174663  0.292045  1
  Sm  Sm6  1  0.194968  0.795004  0.323109  1
  Sm  Sm7  1  1.005107  0.705442  0.286202  1
  Sm  Sm8  1  0.998242  0.442650  0.228135  1
  Sm  Sm9  1  0.995804  0.072624  0.256443  1
  Sm  Sm10  1  0.705003  0.755850  0.298791  1
  Sm  Sm11  1  0.691835  0.520155  0.232721  1
  Sm  Sm12  1  0.692349  0.129412  0.262237  1
  Sm  Sm13  1  0.329210  0.485609  0.305734  1
  Sm  Sm14  1  0.353304  0.247109  0.244492  1
  Sm  Sm15  1  0.333597  0.867519  0.279004  1
  Sm  Sm16  1  0.020324  0.537438  0.317996  1
  Sm  Sm17  1  0.032012  0.290638  0.258834  1
  Sm  Sm18  1  1.013004  0.912931  0.288834  1
  Sm  Sm19  1  0.823283  0.835844  0.246613  1
  Sm  Sm20  1  0.825750  0.447678  0.284565  1
  Sm  Sm21  1  0.844203  0.229629  0.219422  1
  Sm  Sm22  1  0.518770  0.764947  0.243440  1
  Sm  Sm23  1  0.526329  0.390418  0.272932  1
  Sm  Sm24  1  0.522682  1.009179  0.305357  1
  Sm  Sm25  1  0.506914  0.463715  0.364675  1
  Sm  Sm26  1  0.504798  0.085772  0.395418  1
  Sm  Sm27  1  0.509814  0.844489  0.335211  1
  Sm  Sm28  1  0.198102  0.414484  0.353615  1
  Sm  Sm29  1  0.194934  0.034471  0.385034  1
  Sm  Sm30  1  0.194763  0.653968  0.416692  1
  Sm  Sm31  1  1.010721  0.562183  0.380265  1
  Sm  Sm32  1  1.008979  0.320267  0.319285  1
  Sm  Sm33  1  1.006364  0.942039  0.350627  1
  Sm  Sm34  1  0.693463  0.609892  0.390850  1
  Sm  Sm35  1  0.697876  0.370749  0.329625  1
  Sm  Sm36  1  0.694800  0.992543  0.361545  1
  Sm  Sm37  1  0.333560  0.344531  0.401267  1
  Sm  Sm38  1  0.331200  0.104783  0.337633  1
  Sm  Sm39  1  0.332083  0.723748  0.369717  1
  Sm  Sm40  1  0.022883  0.394888  0.410518  1
  Sm  Sm41  1  0.018876  0.154657  0.349602  1
  Sm  Sm42  1  0.022720  0.774162  0.380333  1
  Sm  Sm43  1  0.833492  0.682218  0.345181  1
  Sm  Sm44  1  0.836243  0.302489  0.375950  1
  Sm  Sm45  1  0.823695  0.064978  0.314230  1
  Sm  Sm46  1  0.520920  0.631167  0.335183  1
  Sm  Sm47  1  0.517682  0.253464  0.365081  1
  Sm  Sm48  1  0.519094  0.871071  0.396353  1
  Sm  Sm49  1  0.508030  0.323608  0.456909  1
  Sm  Sm50  1  0.508461  0.942802  0.487534  1
  Sm  Sm51  1  0.507020  0.703627  0.426102  1
  Sm  Sm52  1  0.192790  0.274131  0.447627  1
  Sm  Sm53  1  0.192414  0.893845  0.478067  1
  Sm  Sm54  1  0.192107  0.513400  0.507955  1
  Sm  Sm55  1  1.006995  0.419746  0.472932  1
  Sm  Sm56  1  1.009653  0.181949  0.411447  1
  Sm  Sm57  1  1.008307  0.800417  0.442307  1
  Sm  Sm58  1  0.694279  0.469514  0.482621  1
  Sm  Sm59  1  0.691675  0.230736  0.421321  1
  Sm  Sm60  1  0.692214  0.849918  0.451725  1
  Sm  Sm61  1  0.336889  0.203054  0.493169  1
  Sm  Sm62  1  0.334286  0.964276  0.431869  1
  Sm  Sm63  1  0.336351  0.583872  0.462766  1
  Sm  Sm64  1  0.018911  0.251840  0.503043  1
  Sm  Sm65  1  0.021570  1.014043  0.441558  1
  Sm  Sm66  1  0.020258  0.633372  0.472183  1
  Sm  Sm67  1  0.836151  0.539945  0.436423  1
  Sm  Sm68  1  0.835775  0.159658  0.466863  1
  Sm  Sm69  1  0.836457  0.920390  0.406535  1
  Sm  Sm70  1  0.520104  0.490988  0.426956  1
  Sm  Sm71  1  0.520535  0.110182  0.457582  1
  Sm  Sm72  1  0.521545  0.730163  0.488388  1
  Sm  Sm73  1  0.510883  0.180326  0.549409  1
  Sm  Sm74  1  0.507645  0.802622  0.579308  1
  Sm  Sm75  1  0.509471  0.562718  0.518137  1
  Sm  Sm76  1  0.192322  0.131300  0.538541  1
  Sm  Sm77  1  0.195073  0.751572  0.569309  1
  Sm  Sm78  1  0.204869  0.368812  0.600260  1
  Sm  Sm79  1  1.009688  0.279133  0.564888  1
  Sm  Sm80  1  1.005682  0.038902  0.503972  1
  Sm  Sm81  1  1.005845  0.659628  0.534158  1
  Sm  Sm82  1  0.697365  0.329007  0.576857  1
  Sm  Sm83  1  0.695005  0.089258  0.513223  1
  Sm  Sm84  1  0.696482  0.710041  0.544773  1
  Sm  Sm85  1  0.330689  0.063041  0.584865  1
  Sm  Sm86  1  0.335102  0.823898  0.523640  1
  Sm  Sm87  1  0.333765  0.441246  0.552945  1
  Sm  Sm88  1  0.019586  0.113523  0.595205  1
  Sm  Sm89  1  0.017844  0.871607  0.534226  1
  Sm  Sm90  1  0.022200  0.491750  0.563863  1
  Sm  Sm91  1  0.833630  0.399318  0.529456  1
  Sm  Sm92  1  0.830463  1.019305  0.560876  1
  Sm  Sm93  1  0.833802  0.779821  0.497798  1
  Sm  Sm94  1  0.523766  0.348018  0.519072  1
  Sm  Sm95  1  0.521650  0.970074  0.549815  1
  Sm  Sm96  1  0.518751  0.589301  0.579279  1
  Sm  Sm97  1  0.502235  0.043372  0.641558  1
  Sm  Sm98  1  0.509795  0.668843  0.671050  1
  Sm  Sm99  1  0.505883  0.424611  0.609133  1
  Sm  Sm100  1  0.202815  0.986111  0.629925  1
  Sm  Sm101  1  0.205282  0.597946  0.667878  1
  Sm  Sm102  1  0.184362  0.204161  0.695069  1
  Sm  Sm103  1  0.996553  0.143152  0.655656  1
  Sm  Sm104  1  1.008241  0.896352  0.596494  1
  Sm  Sm105  1  0.015561  0.520859  0.625657  1
  Sm  Sm106  1  0.675261  0.186680  0.669998  1
  Sm  Sm107  1  0.699354  0.948181  0.608757  1
  Sm  Sm108  1  0.694968  0.566270  0.635487  1
  Sm  Sm109  1  0.336730  0.913635  0.681769  1
  Sm  Sm110  1  0.323562  0.677940  0.615699  1
  Sm  Sm111  1  0.336216  0.304378  0.652253  1
  Sm  Sm112  1  0.030322  0.991140  0.686356  1
  Sm  Sm113  1  0.023457  0.728348  0.628288  1
  Sm  Sm114  1  0.032761  0.361165  0.658048  1
  Sm  Sm115  1  0.836574  0.259127  0.622445  1
  Sm  Sm116  1  0.847010  0.868945  0.655279  1
  Sm  Sm117  1  0.833597  0.638785  0.591381  1
  Sm  Sm118  1  0.510131  0.209933  0.611390  1
  Sm  Sm119  1  0.517207  0.829212  0.640224  1
  Sm  Sm120  1  0.535881  0.456381  0.671926  1
  Al  Al121  1  0.261401  0.638115  0.308622  1
  Al  Al122  1  0.258310  0.399999  0.252722  1
  Al  Al123  1  0.261579  1.019414  0.283302  1
  Al  Al124  1  0.766853  0.600843  0.299595  1
  Al  Al125  1  0.768328  0.365979  0.241833  1
  Al  Al126  1  0.761822  0.977642  0.270642  1
  Al  Al127  1  0.434838  0.737984  0.300092  1
  Al  Al128  1  0.414211  0.497337  0.242647  1
  Al  Al129  1  0.426702  0.114455  0.272173  1
  Al  Al130  1  0.915167  0.572047  0.262234  1
  Al  Al131  1  0.921533  0.187675  0.292641  1
  Al  Al132  1  0.184378  0.951942  0.245288  1
  Al  Al133  1  0.271195  0.714726  0.267966  1
  Al  Al134  1  0.270128  0.326764  0.293589  1
  Al  Al135  1  0.259412  0.090629  0.241609  1
  Al  Al136  1  0.757016  0.672598  0.255090  1
  Al  Al137  1  0.768416  0.288632  0.283862  1
  Al  Al138  1  0.759069  0.909792  0.315739  1
  Al  Al139  1  0.110355  0.813458  0.253088  1
  Al  Al140  1  0.094087  0.428673  0.283506  1
  Al  Al141  1  0.091011  0.046828  0.313804  1
  Al  Al142  1  0.597436  0.499463  0.310489  1
  Al  Al143  1  0.615855  0.265586  0.248427  1
  Al  Al144  1  0.601524  0.879279  0.279539  1
  Al  Al145  1  0.259897  0.496939  0.400554  1
  Al  Al146  1  0.262387  0.257248  0.338448  1
  Al  Al147  1  0.260731  0.876806  0.370274  1
  Al  Al148  1  0.769540  0.457921  0.390041  1
  Al  Al149  1  0.770508  0.219012  0.330293  1
  Al  Al150  1  0.767867  0.838331  0.360755  1
  Al  Al151  1  0.422713  0.594130  0.390112  1
  Al  Al152  1  0.428305  0.357136  0.327330  1
  Al  Al153  1  0.424364  0.976257  0.359949  1
  Al  Al154  1  0.927908  0.431630  0.354432  1
  Al  Al155  1  0.925596  0.051277  0.386325  1
  Al  Al156  1  0.927876  0.810678  0.325832  1
  Al  Al157  1  0.268188  0.567244  0.353779  1
  Al  Al158  1  0.268448  0.187118  0.384870  1
  Al  Al159  1  0.263377  0.947863  0.325619  1
  Al  Al160  1  0.761673  0.528275  0.344520  1
  Al  Al161  1  0.760628  0.149350  0.375757  1
  Al  Al162  1  0.761051  0.767427  0.405969  1
  Al  Al163  1  0.102389  0.666678  0.343055  1
  Al  Al164  1  0.106807  0.285235  0.374545  1
  Al  Al165  1  0.106127  0.904573  0.405903  1
  Al  Al166  1  0.604002  0.361155  0.400944  1
  Al  Al167  1  0.599880  0.121459  0.341351  1
  Al  Al168  1  0.602866  0.740043  0.371112  1
  Al  Al169  1  0.261357  0.355830  0.493465  1
  Al  Al170  1  0.259313  0.116888  0.431711  1
  Al  Al171  1  0.259933  0.736571  0.462773  1
  Al  Al172  1  0.769252  0.316902  0.482779  1
  Al  Al173  1  0.767207  0.077960  0.421025  1
  Al  Al174  1  0.768632  0.697219  0.451717  1
  Al  Al175  1  0.424200  0.453051  0.483325  1
  Al  Al176  1  0.421431  0.214409  0.421314  1
  Al  Al177  1  0.422198  0.833568  0.452177  1
  Al  Al178  1  0.922784  0.290736  0.446646  1
  Al  Al179  1  0.922187  0.909990  0.477700  1
  Al  Al180  1  0.924658  0.670142  0.416144  1
  Al  Al181  1  0.268900  0.426902  0.447514  1
  Al  Al182  1  0.268221  0.046083  0.478176  1
  Al  Al183  1  0.268369  0.806583  0.416359  1
  Al  Al184  1  0.760344  0.387706  0.436314  1
  Al  Al185  1  0.759665  1.006887  0.466977  1
  Al  Al186  1  0.760195  0.627207  0.498131  1
  Al  Al187  1  0.106378  0.523799  0.436790  1
  Al  Al188  1  0.105781  0.143053  0.467844  1
  Al  Al189  1  0.103906  0.763648  0.498346  1
  Al  Al190  1  0.607134  0.219381  0.493176  1
  Al  Al191  1  0.604364  0.980738  0.431165  1
  Al  Al192  1  0.606367  0.600222  0.462313  1
  Al  Al193  1  0.258057  0.214777  0.584197  1
  Al  Al194  1  0.259024  0.975869  0.524449  1
  Al  Al195  1  0.260698  0.595458  0.553735  1
  Al  Al196  1  0.766178  0.176541  0.576043  1
  Al  Al197  1  0.768667  0.936851  0.513936  1
  Al  Al198  1  0.767834  0.556983  0.544217  1
  Al  Al199  1  0.428684  0.312331  0.573139  1
  Al  Al200  1  0.424563  0.072634  0.513546  1
  Al  Al201  1  0.425699  0.693746  0.543378  1
  Al  Al202  1  0.921757  0.148554  0.539945  1
  Al  Al203  1  0.926175  0.767112  0.571435  1
  Al  Al204  1  0.922437  0.529217  0.508588  1
  Al  Al205  1  0.267937  0.284440  0.538733  1
  Al  Al206  1  0.266892  0.905515  0.569970  1
  Al  Al207  1  0.267514  0.666362  0.508521  1
  Al  Al208  1  0.760117  0.246672  0.529620  1
  Al  Al209  1  0.760377  0.866546  0.560711  1
  Al  Al210  1  0.765187  0.485927  0.588871  1
  Al  Al211  1  0.102968  0.382512  0.528165  1
  Al  Al212  1  0.100657  1.002160  0.560058  1
  Al  Al213  1  0.100688  0.623112  0.588658  1
  Al  Al214  1  0.600259  0.076653  0.587160  1
  Al  Al215  1  0.605852  0.839660  0.524378  1
  Al  Al216  1  0.604201  0.457533  0.554541  1
  Al  Al217  1  0.260237  0.067811  0.672657  1
  Al  Al218  1  0.261712  0.832947  0.614896  1
  Al  Al219  1  0.266743  0.456148  0.643848  1
  Al  Al220  1  0.770255  0.033791  0.661768  1
  Al  Al221  1  0.767164  0.795674  0.605868  1
  Al  Al222  1  0.766986  0.414376  0.631188  1
  Al  Al223  1  0.412710  0.168204  0.666063  1
  Al  Al224  1  0.431128  0.934326  0.604001  1
  Al  Al225  1  0.427040  0.554510  0.634951  1
  Al  Al226  1  0.934477  1.005116  0.630985  1
  Al  Al227  1  0.918210  0.620331  0.661402  1
  Al  Al228  1  0.937554  0.386962  0.600686  1
  Al  Al229  1  0.260149  0.145158  0.630628  1
  Al  Al230  1  0.271548  0.761192  0.659400  1
  Al  Al231  1  0.269496  0.523997  0.598751  1
  Al  Al232  1  0.758437  0.107026  0.620901  1
  Al  Al233  1  0.757370  0.719064  0.646524  1
  Al  Al234  1  0.769153  0.343161  0.672881  1
  Al  Al235  1  0.107031  0.246115  0.621850  1
  Al  Al236  1  0.113398  0.861742  0.652256  1
  Al  Al237  1  0.844187  0.481847  0.669202  1
  Al  Al238  1  0.614353  0.936453  0.671843  1
  Al  Al239  1  0.593727  0.695806  0.614399  1
  Al  Al240  1  0.601862  0.319335  0.642317  1
