# generated using pymatgen
data_SmAl2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.00096326
_cell_length_b   28.99821385
_cell_length_c   47.07476874
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmAl2
_chemical_formula_sum   'Sm72 Al144'
_cell_volume   10921.9886247
_cell_formula_units_Z   72
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  0.752244  0.828722  0.391841  1
  Sm  Sm2  1  0.773596  0.599784  0.294907  1
  Sm  Sm3  1  0.772827  0.211898  0.341702  1
  Sm  Sm4  1  0.502118  0.732430  0.404400  1
  Sm  Sm5  1  0.496908  0.502457  0.306080  1
  Sm  Sm6  1  0.501091  0.116885  0.357183  1
  Sm  Sm7  1  0.255873  0.713692  0.345244  1
  Sm  Sm8  1  0.260341  0.328721  0.391893  1
  Sm  Sm9  1  0.241081  0.105207  0.296223  1
  Sm  Sm10  1  0.983997  0.002885  0.306262  1
  Sm  Sm11  1  0.006921  0.616820  0.357034  1
  Sm  Sm12  1  0.006077  0.232260  0.403806  1
  Sm  Sm13  1  0.256891  0.905239  0.317557  1
  Sm  Sm14  1  0.260587  0.521293  0.368191  1
  Sm  Sm15  1  0.255391  0.136023  0.416347  1
  Sm  Sm16  1  0.983833  0.807972  0.329041  1
  Sm  Sm17  1  0.004559  0.425138  0.379913  1
  Sm  Sm18  1  1.003734  0.039900  0.427682  1
  Sm  Sm19  1  0.754223  0.636122  0.415720  1
  Sm  Sm20  1  0.768686  0.405462  0.317458  1
  Sm  Sm21  1  0.750688  0.020417  0.368788  1
  Sm  Sm22  1  0.495634  0.925043  0.380127  1
  Sm  Sm23  1  0.520340  0.701806  0.285269  1
  Sm  Sm24  1  0.498832  0.308076  0.329465  1
  Sm  Sm25  1  0.752658  0.674556  0.534994  1
  Sm  Sm26  1  0.755063  0.443917  0.439026  1
  Sm  Sm27  1  0.755152  0.059333  0.487538  1
  Sm  Sm28  1  0.502686  0.578408  0.547139  1
  Sm  Sm29  1  0.507006  0.347828  0.451045  1
  Sm  Sm30  1  0.503631  0.963251  0.499407  1
  Sm  Sm31  1  0.254402  0.559217  0.487204  1
  Sm  Sm32  1  0.256074  0.174716  0.535283  1
  Sm  Sm33  1  0.251417  0.944029  0.439426  1
  Sm  Sm34  1  1.002686  0.848046  0.451303  1
  Sm  Sm35  1  1.003631  0.463203  0.499035  1
  Sm  Sm36  1  0.007006  0.078626  0.547398  1
  Sm  Sm37  1  0.252658  0.751898  0.463448  1
  Sm  Sm38  1  0.255152  0.367121  0.510904  1
  Sm  Sm39  1  0.255063  0.982537  0.559416  1
  Sm  Sm40  1  1.003545  0.655445  0.475356  1
  Sm  Sm41  1  0.005989  0.270867  0.522961  1
  Sm  Sm42  1  0.006614  0.886394  0.571155  1
  Sm  Sm43  1  0.751417  0.482424  0.559016  1
  Sm  Sm44  1  0.756074  0.251738  0.463159  1
  Sm  Sm45  1  0.754402  0.867237  0.511239  1
  Sm  Sm46  1  0.503545  0.771009  0.523087  1
  Sm  Sm47  1  0.506614  0.540060  0.427287  1
  Sm  Sm48  1  0.505989  0.155587  0.475481  1
  Sm  Sm49  1  0.756891  0.521215  0.680885  1
  Sm  Sm50  1  0.755391  0.290431  0.582095  1
  Sm  Sm51  1  0.760587  0.905161  0.630251  1
  Sm  Sm52  1  0.483997  0.423569  0.692180  1
  Sm  Sm53  1  0.506077  0.194194  0.594636  1
  Sm  Sm54  1  0.506921  0.809633  0.641409  1
  Sm  Sm55  1  0.250688  0.406037  0.629654  1
  Sm  Sm56  1  0.268686  0.020991  0.680984  1
  Sm  Sm57  1  0.254223  0.790332  0.582722  1
  Sm  Sm58  1  1.002118  0.694023  0.594043  1
  Sm  Sm59  1  1.001091  0.309569  0.641259  1
  Sm  Sm60  1  0.996908  0.923997  0.692362  1
  Sm  Sm61  1  0.252244  0.597731  0.606601  1
  Sm  Sm62  1  0.272827  0.214556  0.656741  1
  Sm  Sm63  1  0.273596  0.826670  0.703535  1
  Sm  Sm64  1  0.995634  0.501411  0.618315  1
  Sm  Sm65  1  0.998832  0.118378  0.668977  1
  Sm  Sm66  1  0.020340  0.724648  0.713173  1
  Sm  Sm67  1  0.741081  0.321247  0.702220  1
  Sm  Sm68  1  0.760341  0.097733  0.606549  1
  Sm  Sm69  1  0.755873  0.712762  0.653198  1
  Sm  Sm70  1  0.483833  0.618482  0.669402  1
  Sm  Sm71  1  0.503734  0.386554  0.570761  1
  Sm  Sm72  1  0.504559  1.001315  0.618529  1
  Al  Al73  1  0.870604  0.897020  0.293561  1
  Al  Al74  1  0.879638  0.511867  0.336997  1
  Al  Al75  1  0.879454  0.126284  0.386122  1
  Al  Al76  1  0.874411  0.915738  0.350498  1
  Al  Al77  1  0.880647  0.530259  0.397173  1
  Al  Al78  1  0.881628  0.299783  0.304905  1
  Al  Al79  1  0.621205  0.857859  0.328018  1
  Al  Al80  1  0.632790  0.472816  0.372255  1
  Al  Al81  1  0.628806  0.088137  0.421989  1
  Al  Al82  1  0.619216  0.954992  0.316731  1
  Al  Al83  1  0.633136  0.569091  0.360860  1
  Al  Al84  1  0.633622  0.184594  0.409091  1
  Al  Al85  1  0.382204  0.626685  0.385537  1
  Al  Al86  1  0.382999  0.396536  0.293561  1
  Al  Al87  1  0.365325  0.012385  0.336937  1
  Al  Al88  1  0.366239  0.799234  0.304928  1
  Al  Al89  1  0.384555  0.415759  0.350409  1
  Al  Al90  1  0.375355  0.030167  0.397478  1
  Al  Al91  1  0.130638  0.588077  0.421759  1
  Al  Al92  1  0.133437  0.357847  0.328189  1
  Al  Al93  1  0.124258  0.972657  0.372497  1
  Al  Al94  1  0.129229  0.684545  0.409947  1
  Al  Al95  1  0.131887  0.454855  0.316400  1
  Al  Al96  1  0.125372  0.068663  0.361779  1
  Al  Al97  1  0.370830  0.819660  0.362447  1
  Al  Al98  1  0.383208  0.434361  0.409296  1
  Al  Al99  1  0.386116  0.203701  0.316397  1
  Al  Al100  1  0.375048  0.838484  0.421518  1
  Al  Al101  1  0.391975  0.608792  0.325329  1
  Al  Al102  1  0.386419  0.222768  0.374224  1
  Al  Al103  1  0.123903  0.781141  0.397120  1
  Al  Al104  1  0.136159  0.552019  0.305263  1
  Al  Al105  1  0.133226  0.164939  0.351355  1
  Al  Al106  1  0.123691  0.876565  0.384147  1
  Al  Al107  1  0.144593  0.649319  0.294005  1
  Al  Al108  1  0.134599  0.261697  0.339753  1
  Al  Al109  1  0.886042  0.702871  0.315503  1
  Al  Al110  1  0.881116  0.319307  0.362241  1
  Al  Al111  1  0.877180  0.934182  0.409582  1
  Al  Al112  1  0.877854  0.722753  0.374411  1
  Al  Al113  1  0.880680  0.338168  0.421186  1
  Al  Al114  1  0.874985  0.105983  0.327257  1
  Al  Al115  1  0.633427  0.665137  0.349983  1
  Al  Al116  1  0.633072  0.280247  0.396250  1
  Al  Al117  1  0.614787  0.050974  0.305248  1
  Al  Al118  1  0.623896  0.761578  0.340045  1
  Al  Al119  1  0.632614  0.376392  0.384025  1
  Al  Al120  1  0.624388  0.145162  0.294593  1
  Al  Al121  1  0.878056  0.742216  0.433688  1
  Al  Al122  1  0.880619  0.357496  0.481012  1
  Al  Al123  1  0.880047  0.972880  0.529301  1
  Al  Al124  1  0.878262  0.761456  0.493249  1
  Al  Al125  1  0.878978  0.376901  0.540749  1
  Al  Al126  1  0.880224  0.145835  0.445659  1
  Al  Al127  1  0.628548  0.703573  0.469544  1
  Al  Al128  1  0.630107  0.319109  0.516806  1
  Al  Al129  1  0.630753  0.934461  0.565053  1
  Al  Al130  1  0.627553  0.799962  0.457486  1
  Al  Al131  1  0.629447  0.415187  0.504929  1
  Al  Al132  1  0.631003  0.030548  0.553218  1
  Al  Al133  1  0.378209  0.472850  0.528943  1
  Al  Al134  1  0.382937  0.242064  0.433375  1
  Al  Al135  1  0.378182  0.857659  0.481351  1
  Al  Al136  1  0.379246  0.645733  0.445603  1
  Al  Al137  1  0.380996  0.261318  0.493118  1
  Al  Al138  1  0.379658  0.876896  0.541145  1
  Al  Al139  1  0.127173  0.434532  0.564629  1
  Al  Al140  1  0.131215  0.203597  0.469450  1
  Al  Al141  1  0.128849  0.819195  0.517111  1
  Al  Al142  1  0.127128  0.530502  0.552938  1
  Al  Al143  1  0.131279  0.299752  0.457230  1
  Al  Al144  1  0.129063  0.915265  0.505327  1
  Al  Al145  1  0.378262  0.664997  0.505194  1
  Al  Al146  1  0.380224  0.280619  0.552783  1
  Al  Al147  1  0.378978  0.049553  0.457694  1
  Al  Al148  1  0.378056  0.684238  0.564754  1
  Al  Al149  1  0.380047  0.453574  0.469142  1
  Al  Al150  1  0.380619  0.068957  0.517430  1
  Al  Al151  1  0.127553  0.626492  0.540957  1
  Al  Al152  1  0.131003  0.395905  0.445224  1
  Al  Al153  1  0.129447  0.011267  0.493513  1
  Al  Al154  1  0.128548  0.722881  0.528898  1
  Al  Al155  1  0.130753  0.491993  0.433389  1
  Al  Al156  1  0.130107  0.107345  0.481637  1
  Al  Al157  1  0.879658  0.549557  0.457297  1
  Al  Al158  1  0.880996  0.165136  0.505325  1
  Al  Al159  1  0.879246  0.780721  0.552840  1
  Al  Al160  1  0.878182  0.568795  0.517091  1
  Al  Al161  1  0.882937  0.184390  0.565068  1
  Al  Al162  1  0.878209  0.953604  0.469499  1
  Al  Al163  1  0.629063  0.511189  0.493115  1
  Al  Al164  1  0.631279  0.126702  0.541213  1
  Al  Al165  1  0.627128  0.895952  0.445505  1
  Al  Al166  1  0.628849  0.607259  0.481332  1
  Al  Al167  1  0.631215  0.222856  0.528993  1
  Al  Al168  1  0.627173  0.991921  0.433814  1
  Al  Al169  1  0.875048  0.587970  0.576924  1
  Al  Al170  1  0.886419  0.203686  0.624218  1
  Al  Al171  1  0.891975  0.817661  0.673114  1
  Al  Al172  1  0.870830  0.606794  0.635995  1
  Al  Al173  1  0.886116  0.222752  0.682046  1
  Al  Al174  1  0.883208  0.992093  0.589147  1
  Al  Al175  1  0.623691  0.549888  0.614295  1
  Al  Al176  1  0.634599  0.164756  0.658689  1
  Al  Al177  1  0.644593  0.777134  0.704438  1
  Al  Al178  1  0.623903  0.645313  0.601323  1
  Al  Al179  1  0.633226  0.261514  0.647087  1
  Al  Al180  1  0.636159  0.874434  0.693180  1
  Al  Al181  1  0.374985  0.320471  0.671186  1
  Al  Al182  1  0.380680  0.088286  0.577257  1
  Al  Al183  1  0.377854  0.703700  0.624032  1
  Al  Al184  1  0.377180  0.492271  0.588861  1
  Al  Al185  1  0.381116  0.107147  0.636202  1
  Al  Al186  1  0.386042  0.723583  0.682940  1
  Al  Al187  1  0.124388  0.281292  0.703850  1
  Al  Al188  1  0.132614  0.050062  0.614418  1
  Al  Al189  1  0.123896  0.664876  0.658397  1
  Al  Al190  1  0.114787  0.375480  0.693194  1
  Al  Al191  1  0.133072  0.146206  0.602192  1
  Al  Al192  1  0.133427  0.761317  0.648459  1
  Al  Al193  1  0.374411  0.510716  0.647945  1
  Al  Al194  1  0.381628  0.126671  0.693537  1
  Al  Al195  1  0.380647  0.896195  0.601269  1
  Al  Al196  1  0.370604  0.529434  0.704881  1
  Al  Al197  1  0.379454  0.300169  0.612321  1
  Al  Al198  1  0.379638  0.914587  0.661445  1
  Al  Al199  1  0.119216  0.471462  0.681712  1
  Al  Al200  1  0.133622  0.241859  0.589352  1
  Al  Al201  1  0.133136  0.857363  0.637582  1
  Al  Al202  1  0.121205  0.568595  0.670425  1
  Al  Al203  1  0.128806  0.338317  0.576453  1
  Al  Al204  1  0.132790  0.953637  0.626187  1
  Al  Al205  1  0.875355  0.396287  0.600964  1
  Al  Al206  1  0.884555  0.010695  0.648034  1
  Al  Al207  1  0.866239  0.627219  0.693514  1
  Al  Al208  1  0.865325  0.414069  0.661506  1
  Al  Al209  1  0.882999  0.029918  0.704881  1
  Al  Al210  1  0.882204  0.799769  0.612905  1
  Al  Al211  1  0.625372  0.357791  0.636663  1
  Al  Al212  1  0.631887  0.971599  0.682043  1
  Al  Al213  1  0.629229  0.741909  0.588496  1
  Al  Al214  1  0.624258  0.453797  0.625945  1
  Al  Al215  1  0.633437  0.068607  0.670253  1
  Al  Al216  1  0.630638  0.838377  0.576683  1
