# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   37.04748549
_cell_length_b   12.66123913
_cell_length_c   47.89237485
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   73.90340000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm288
_cell_volume   21584.0197789
_cell_formula_units_Z   288
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  0.638493  0.359587  0.263935  1
  Sm  Sm2  1  0.305160  0.359587  0.263935  1
  Sm  Sm3  1  0.662453  0.059245  0.278255  1
  Sm  Sm4  1  0.971827  0.359587  0.263935  1
  Sm  Sm5  1  0.329120  0.059245  0.278255  1
  Sm  Sm6  1  0.633760  0.820849  0.302083  1
  Sm  Sm7  1  0.995787  0.059245  0.278255  1
  Sm  Sm8  1  0.300426  0.820849  0.302083  1
  Sm  Sm9  1  0.967093  0.820849  0.302083  1
  Sm  Sm10  1  0.812885  0.217246  0.274043  1
  Sm  Sm11  1  0.479552  0.217246  0.274043  1
  Sm  Sm12  1  0.787668  0.953795  0.285268  1
  Sm  Sm13  1  0.146219  0.217246  0.274043  1
  Sm  Sm14  1  0.454335  0.953795  0.285268  1
  Sm  Sm15  1  0.804366  0.681916  0.312086  1
  Sm  Sm16  1  0.121002  0.953795  0.285268  1
  Sm  Sm17  1  0.471033  0.681916  0.312086  1
  Sm  Sm18  1  0.137699  0.681916  0.312086  1
  Sm  Sm19  1  0.897020  0.175414  0.309305  1
  Sm  Sm20  1  0.563686  0.175414  0.309305  1
  Sm  Sm21  1  0.891597  0.714022  0.272795  1
  Sm  Sm22  1  0.230353  0.175414  0.309305  1
  Sm  Sm23  1  0.558264  0.714022  0.272795  1
  Sm  Sm24  1  0.881915  0.450718  0.292115  1
  Sm  Sm25  1  0.224931  0.714022  0.272795  1
  Sm  Sm26  1  0.548581  0.450718  0.292115  1
  Sm  Sm27  1  0.215248  0.450718  0.292115  1
  Sm  Sm28  1  0.723587  0.473077  0.285852  1
  Sm  Sm29  1  0.390253  0.473077  0.285852  1
  Sm  Sm30  1  0.721460  0.205568  0.309343  1
  Sm  Sm31  1  0.056920  0.473077  0.285852  1
  Sm  Sm32  1  0.388126  0.205568  0.309343  1
  Sm  Sm33  1  0.722697  0.747097  0.268267  1
  Sm  Sm34  1  0.054793  0.205568  0.309343  1
  Sm  Sm35  1  0.389364  0.747097  0.268267  1
  Sm  Sm36  1  0.056031  0.747097  0.268267  1
  Sm  Sm37  1  0.636860  0.546932  0.321076  1
  Sm  Sm38  1  0.303526  0.546932  0.321076  1
  Sm  Sm39  1  0.633665  0.286150  0.340588  1
  Sm  Sm40  1  0.970193  0.546932  0.321076  1
  Sm  Sm41  1  0.300332  0.286150  0.340588  1
  Sm  Sm42  1  0.630833  0.026188  0.359692  1
  Sm  Sm43  1  0.966998  0.286150  0.340588  1
  Sm  Sm44  1  0.297499  0.026188  0.359692  1
  Sm  Sm45  1  0.964166  0.026188  0.359692  1
  Sm  Sm46  1  0.801800  0.412876  0.331890  1
  Sm  Sm47  1  0.468466  0.412876  0.331890  1
  Sm  Sm48  1  0.800784  0.150925  0.350037  1
  Sm  Sm49  1  0.135133  0.412876  0.331890  1
  Sm  Sm50  1  0.467451  0.150925  0.350037  1
  Sm  Sm51  1  0.797946  0.894742  0.369643  1
  Sm  Sm52  1  0.134118  0.150925  0.350037  1
  Sm  Sm53  1  0.464613  0.894742  0.369643  1
  Sm  Sm54  1  0.131280  0.894742  0.369643  1
  Sm  Sm55  1  0.881116  0.398633  0.370168  1
  Sm  Sm56  1  0.547783  0.398633  0.370168  1
  Sm  Sm57  1  0.877746  0.926046  0.328679  1
  Sm  Sm58  1  0.214450  0.398633  0.370168  1
  Sm  Sm59  1  0.544413  0.926046  0.328679  1
  Sm  Sm60  1  0.884635  0.658764  0.351746  1
  Sm  Sm61  1  0.211079  0.926046  0.328679  1
  Sm  Sm62  1  0.551302  0.658764  0.351746  1
  Sm  Sm63  1  0.217969  0.658764  0.351746  1
  Sm  Sm64  1  0.715682  0.655688  0.347927  1
  Sm  Sm65  1  0.382349  0.655688  0.347927  1
  Sm  Sm66  1  0.714645  0.396235  0.368554  1
  Sm  Sm67  1  0.049016  0.655688  0.347927  1
  Sm  Sm68  1  0.381312  0.396235  0.368554  1
  Sm  Sm69  1  0.718144  0.921737  0.332701  1
  Sm  Sm70  1  0.047979  0.396235  0.368554  1
  Sm  Sm71  1  0.384810  0.921737  0.332701  1
  Sm  Sm72  1  0.051477  0.921737  0.332701  1
  Sm  Sm73  1  0.629922  0.767153  0.379372  1
  Sm  Sm74  1  0.296589  0.767153  0.379372  1
  Sm  Sm75  1  0.628017  0.502113  0.398578  1
  Sm  Sm76  1  0.963256  0.767153  0.379372  1
  Sm  Sm77  1  0.294683  0.502113  0.398578  1
  Sm  Sm78  1  0.625407  0.239838  0.418997  1
  Sm  Sm79  1  0.961350  0.502113  0.398578  1
  Sm  Sm80  1  0.292074  0.239838  0.418997  1
  Sm  Sm81  1  0.958741  0.239838  0.418997  1
  Sm  Sm82  1  0.794488  0.635329  0.389085  1
  Sm  Sm83  1  0.461154  0.635329  0.389085  1
  Sm  Sm84  1  0.794035  0.369254  0.408436  1
  Sm  Sm85  1  0.127821  0.635329  0.389085  1
  Sm  Sm86  1  0.460702  0.369254  0.408436  1
  Sm  Sm87  1  0.791272  0.107938  0.428805  1
  Sm  Sm88  1  0.127368  0.369254  0.408436  1
  Sm  Sm89  1  0.457938  0.107938  0.428805  1
  Sm  Sm90  1  0.124605  0.107938  0.428805  1
  Sm  Sm91  1  0.874306  0.609015  0.429319  1
  Sm  Sm92  1  0.540972  0.609015  0.429319  1
  Sm  Sm93  1  0.878729  0.136210  0.389113  1
  Sm  Sm94  1  0.207639  0.609015  0.429319  1
  Sm  Sm95  1  0.545396  0.136210  0.389113  1
  Sm  Sm96  1  0.876284  0.873586  0.408986  1
  Sm  Sm97  1  0.212062  0.136210  0.389113  1
  Sm  Sm98  1  0.542951  0.873586  0.408986  1
  Sm  Sm99  1  0.209618  0.873586  0.408986  1
  Sm  Sm100  1  0.709945  0.870446  0.408095  1
  Sm  Sm101  1  0.376612  0.870446  0.408095  1
  Sm  Sm102  1  0.707696  0.607473  0.427078  1
  Sm  Sm103  1  0.043278  0.870446  0.408095  1
  Sm  Sm104  1  0.374363  0.607473  0.427078  1
  Sm  Sm105  1  0.712194  0.134515  0.387914  1
  Sm  Sm106  1  0.041030  0.607473  0.427078  1
  Sm  Sm107  1  0.378860  0.134515  0.387914  1
  Sm  Sm108  1  0.045527  0.134515  0.387914  1
  Sm  Sm109  1  0.622700  0.977224  0.437906  1
  Sm  Sm110  1  0.289366  0.977224  0.437906  1
  Sm  Sm111  1  0.621070  0.714446  0.457645  1
  Sm  Sm112  1  0.956033  0.977224  0.437906  1
  Sm  Sm113  1  0.287737  0.714446  0.457645  1
  Sm  Sm114  1  0.619242  0.451796  0.477094  1
  Sm  Sm115  1  0.954404  0.714446  0.457645  1
  Sm  Sm116  1  0.285908  0.451796  0.477094  1
  Sm  Sm117  1  0.952575  0.451796  0.477094  1
  Sm  Sm118  1  0.789351  0.844886  0.447861  1
  Sm  Sm119  1  0.456017  0.844886  0.447861  1
  Sm  Sm120  1  0.786666  0.582589  0.467273  1
  Sm  Sm121  1  0.122684  0.844886  0.447861  1
  Sm  Sm122  1  0.453332  0.582589  0.467273  1
  Sm  Sm123  1  0.784832  0.320076  0.487025  1
  Sm  Sm124  1  0.119999  0.582589  0.467273  1
  Sm  Sm125  1  0.451498  0.320076  0.487025  1
  Sm  Sm126  1  0.118165  0.320076  0.487025  1
  Sm  Sm127  1  0.868031  0.821821  0.487970  1
  Sm  Sm128  1  0.534698  0.821821  0.487970  1
  Sm  Sm129  1  0.872230  0.346334  0.449120  1
  Sm  Sm130  1  0.201365  0.821821  0.487970  1
  Sm  Sm131  1  0.538897  0.346334  0.449120  1
  Sm  Sm132  1  0.870166  0.084463  0.468497  1
  Sm  Sm133  1  0.205563  0.346334  0.449120  1
  Sm  Sm134  1  0.536833  0.084463  0.468497  1
  Sm  Sm135  1  0.203500  0.084463  0.468497  1
  Sm  Sm136  1  0.703679  0.081226  0.466233  1
  Sm  Sm137  1  0.370346  0.081226  0.466233  1
  Sm  Sm138  1  0.701477  0.818634  0.486098  1
  Sm  Sm139  1  0.037012  0.081226  0.466233  1
  Sm  Sm140  1  0.368144  0.818634  0.486098  1
  Sm  Sm141  1  0.705981  0.344640  0.446574  1
  Sm  Sm142  1  0.034811  0.818634  0.486098  1
  Sm  Sm143  1  0.372648  0.344640  0.446574  1
  Sm  Sm144  1  0.039315  0.344640  0.446574  1
  Sm  Sm145  1  0.617042  0.188964  0.496917  1
  Sm  Sm146  1  0.283708  0.188964  0.496917  1
  Sm  Sm147  1  0.614788  0.926134  0.516518  1
  Sm  Sm148  1  0.950375  0.188964  0.496917  1
  Sm  Sm149  1  0.281454  0.926134  0.516518  1
  Sm  Sm150  1  0.612777  0.663704  0.535967  1
  Sm  Sm151  1  0.948121  0.926134  0.516518  1
  Sm  Sm152  1  0.279444  0.663704  0.535967  1
  Sm  Sm153  1  0.946111  0.663704  0.535967  1
  Sm  Sm154  1  0.782718  0.057111  0.506687  1
  Sm  Sm155  1  0.449385  0.057111  0.506687  1
  Sm  Sm156  1  0.780741  0.794884  0.526271  1
  Sm  Sm157  1  0.116052  0.057111  0.506687  1
  Sm  Sm158  1  0.447407  0.794884  0.526271  1
  Sm  Sm159  1  0.777845  0.532599  0.545486  1
  Sm  Sm160  1  0.114074  0.794884  0.526271  1
  Sm  Sm161  1  0.444512  0.532599  0.545486  1
  Sm  Sm162  1  0.111179  0.532599  0.545486  1
  Sm  Sm163  1  0.861444  0.032354  0.547172  1
  Sm  Sm164  1  0.528111  0.032354  0.547172  1
  Sm  Sm165  1  0.865860  0.558544  0.507588  1
  Sm  Sm166  1  0.194777  0.032354  0.547172  1
  Sm  Sm167  1  0.532527  0.558544  0.507588  1
  Sm  Sm168  1  0.863726  0.295558  0.527624  1
  Sm  Sm169  1  0.199193  0.558544  0.507588  1
  Sm  Sm170  1  0.530393  0.295558  0.527624  1
  Sm  Sm171  1  0.197060  0.295558  0.527624  1
  Sm  Sm172  1  0.697362  0.293160  0.525031  1
  Sm  Sm173  1  0.364028  0.293160  0.525031  1
  Sm  Sm174  1  0.695249  0.030705  0.544650  1
  Sm  Sm175  1  0.030695  0.293160  0.525031  1
  Sm  Sm176  1  0.361915  0.030705  0.544650  1
  Sm  Sm177  1  0.699194  0.555697  0.505540  1
  Sm  Sm178  1  0.028582  0.030705  0.544650  1
  Sm  Sm179  1  0.365861  0.555697  0.505540  1
  Sm  Sm180  1  0.032527  0.555697  0.505540  1
  Sm  Sm181  1  0.611431  0.401163  0.555568  1
  Sm  Sm182  1  0.278097  0.401163  0.555568  1
  Sm  Sm183  1  0.608563  0.137812  0.574897  1
  Sm  Sm184  1  0.944764  0.401163  0.555568  1
  Sm  Sm185  1  0.275230  0.137812  0.574897  1
  Sm  Sm186  1  0.606071  0.875067  0.594912  1
  Sm  Sm187  1  0.941896  0.137812  0.574897  1
  Sm  Sm188  1  0.272738  0.875067  0.594912  1
  Sm  Sm189  1  0.939404  0.875067  0.594912  1
  Sm  Sm190  1  0.776112  0.269229  0.564951  1
  Sm  Sm191  1  0.442778  0.269229  0.564951  1
  Sm  Sm192  1  0.773887  0.006966  0.585254  1
  Sm  Sm193  1  0.109445  0.269229  0.564951  1
  Sm  Sm194  1  0.440553  0.006966  0.585254  1
  Sm  Sm195  1  0.772503  0.742788  0.604544  1
  Sm  Sm196  1  0.107220  0.006966  0.585254  1
  Sm  Sm197  1  0.439169  0.742788  0.604544  1
  Sm  Sm198  1  0.105836  0.742788  0.604544  1
  Sm  Sm199  1  0.855240  0.242305  0.605970  1
  Sm  Sm200  1  0.521907  0.242305  0.605970  1
  Sm  Sm201  1  0.859550  0.769663  0.566656  1
  Sm  Sm202  1  0.188574  0.242305  0.605970  1
  Sm  Sm203  1  0.526216  0.769663  0.566656  1
  Sm  Sm204  1  0.857432  0.506418  0.585453  1
  Sm  Sm205  1  0.192883  0.769663  0.566656  1
  Sm  Sm206  1  0.524099  0.506418  0.585453  1
  Sm  Sm207  1  0.190765  0.506418  0.585453  1
  Sm  Sm208  1  0.690542  0.504528  0.584686  1
  Sm  Sm209  1  0.357209  0.504528  0.584686  1
  Sm  Sm210  1  0.689487  0.239071  0.604020  1
  Sm  Sm211  1  0.023875  0.504528  0.584686  1
  Sm  Sm212  1  0.356153  0.239071  0.604020  1
  Sm  Sm213  1  0.693021  0.767868  0.564402  1
  Sm  Sm214  1  0.022820  0.239071  0.604020  1
  Sm  Sm215  1  0.359688  0.767868  0.564402  1
  Sm  Sm216  1  0.026354  0.767868  0.564402  1
  Sm  Sm217  1  0.603540  0.615034  0.614790  1
  Sm  Sm218  1  0.270206  0.615034  0.614790  1
  Sm  Sm219  1  0.604306  0.355044  0.632861  1
  Sm  Sm220  1  0.936873  0.615034  0.614790  1
  Sm  Sm221  1  0.270972  0.355044  0.632861  1
  Sm  Sm222  1  0.600973  0.094672  0.652330  1
  Sm  Sm223  1  0.937639  0.355044  0.632861  1
  Sm  Sm224  1  0.267640  0.094672  0.652330  1
  Sm  Sm225  1  0.934307  0.094672  0.652330  1
  Sm  Sm226  1  0.768826  0.486482  0.622939  1
  Sm  Sm227  1  0.435493  0.486482  0.622939  1
  Sm  Sm228  1  0.768558  0.227022  0.643297  1
  Sm  Sm229  1  0.102159  0.486482  0.622939  1
  Sm  Sm230  1  0.435225  0.227022  0.643297  1
  Sm  Sm231  1  0.764675  0.963006  0.661530  1
  Sm  Sm232  1  0.101891  0.227022  0.643297  1
  Sm  Sm233  1  0.431342  0.963006  0.661530  1
  Sm  Sm234  1  0.098009  0.963006  0.661530  1
  Sm  Sm235  1  0.849460  0.447280  0.660747  1
  Sm  Sm236  1  0.516126  0.447280  0.660747  1
  Sm  Sm237  1  0.853193  0.977803  0.625792  1
  Sm  Sm238  1  0.182793  0.447280  0.660747  1
  Sm  Sm239  1  0.519860  0.977803  0.625792  1
  Sm  Sm240  1  0.851308  0.716862  0.646009  1
  Sm  Sm241  1  0.186527  0.977803  0.625792  1
  Sm  Sm242  1  0.517975  0.716862  0.646009  1
  Sm  Sm243  1  0.184642  0.716862  0.646009  1
  Sm  Sm244  1  0.681916  0.721431  0.642741  1
  Sm  Sm245  1  0.348583  0.721431  0.642741  1
  Sm  Sm246  1  0.690045  0.451939  0.663860  1
  Sm  Sm247  1  0.015250  0.721431  0.642741  1
  Sm  Sm248  1  0.356712  0.451939  0.663860  1
  Sm  Sm249  1  0.686170  0.977489  0.623545  1
  Sm  Sm250  1  0.023378  0.451939  0.663860  1
  Sm  Sm251  1  0.352836  0.977489  0.623545  1
  Sm  Sm252  1  0.019503  0.977489  0.623545  1
  Sm  Sm253  1  0.596395  0.837208  0.674654  1
  Sm  Sm254  1  0.263062  0.837208  0.674654  1
  Sm  Sm255  1  0.599266  0.556470  0.691810  1
  Sm  Sm256  1  0.929728  0.837208  0.674654  1
  Sm  Sm257  1  0.265933  0.556470  0.691810  1
  Sm  Sm258  1  0.575631  0.297860  0.713131  1
  Sm  Sm259  1  0.932599  0.556470  0.691810  1
  Sm  Sm260  1  0.242297  0.297860  0.713131  1
  Sm  Sm261  1  0.908964  0.297860  0.713131  1
  Sm  Sm262  1  0.763074  0.693766  0.682177  1
  Sm  Sm263  1  0.429741  0.693766  0.682177  1
  Sm  Sm264  1  0.779760  0.412468  0.706805  1
  Sm  Sm265  1  0.096407  0.693766  0.682177  1
  Sm  Sm266  1  0.446427  0.412468  0.706805  1
  Sm  Sm267  1  0.755785  0.152396  0.719986  1
  Sm  Sm268  1  0.113093  0.412468  0.706805  1
  Sm  Sm269  1  0.422452  0.152396  0.719986  1
  Sm  Sm270  1  0.089119  0.152396  0.719986  1
  Sm  Sm271  1  0.844343  0.591194  0.727320  1
  Sm  Sm272  1  0.511010  0.591194  0.727320  1
  Sm  Sm273  1  0.847311  0.149620  0.687045  1
  Sm  Sm274  1  0.177677  0.591194  0.727320  1
  Sm  Sm275  1  0.513978  0.149620  0.687045  1
  Sm  Sm276  1  0.840976  0.876518  0.710358  1
  Sm  Sm277  1  0.180644  0.149620  0.687045  1
  Sm  Sm278  1  0.507642  0.876518  0.710358  1
  Sm  Sm279  1  0.174309  0.876518  0.710358  1
  Sm  Sm280  1  0.679729  0.933413  0.702988  1
  Sm  Sm281  1  0.346395  0.933413  0.702988  1
  Sm  Sm282  1  0.679164  0.647152  0.720124  1
  Sm  Sm283  1  0.013062  0.933413  0.702988  1
  Sm  Sm284  1  0.345830  0.647152  0.720124  1
  Sm  Sm285  1  0.674223  0.205084  0.681835  1
  Sm  Sm286  1  0.012497  0.647152  0.720124  1
  Sm  Sm287  1  0.340890  0.205084  0.681835  1
  Sm  Sm288  1  0.007556  0.205084  0.681835  1
