# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   25.76638761
_cell_length_b   20.52272695
_cell_length_c   47.63685371
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   88.98933091
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm336
_cell_volume   25186.2844024
_cell_formula_units_Z   336
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  0.776010  0.788304  0.327607  1
  Sm  Sm2  1  0.762789  0.624760  0.295680  1
  Sm  Sm3  1  0.262213  0.791073  0.296006  1
  Sm  Sm4  1  0.774216  0.454831  0.327683  1
  Sm  Sm5  1  0.765480  0.292482  0.294557  1
  Sm  Sm6  1  0.274923  0.621325  0.327575  1
  Sm  Sm7  1  0.263835  0.457602  0.295600  1
  Sm  Sm8  1  0.775909  0.121304  0.327753  1
  Sm  Sm9  1  0.765423  0.959202  0.294668  1
  Sm  Sm10  1  0.274555  0.288165  0.327730  1
  Sm  Sm11  1  0.263197  0.123957  0.295949  1
  Sm  Sm12  1  0.274414  0.954825  0.327811  1
  Sm  Sm13  1  1.005903  0.783634  0.279543  1
  Sm  Sm14  1  0.019445  0.619183  0.314656  1
  Sm  Sm15  1  0.519073  0.787096  0.313628  1
  Sm  Sm16  1  1.005035  0.450612  0.279910  1
  Sm  Sm17  1  0.019631  0.285978  0.314724  1
  Sm  Sm18  1  0.505946  0.617725  0.278599  1
  Sm  Sm19  1  0.519007  0.454101  0.314062  1
  Sm  Sm20  1  1.005660  0.117125  0.279678  1
  Sm  Sm21  1  0.019561  0.952549  0.314684  1
  Sm  Sm22  1  0.538943  0.288275  0.343923  1
  Sm  Sm23  1  0.519093  0.121689  0.313634  1
  Sm  Sm24  1  0.538698  0.955949  0.343645  1
  Sm  Sm25  1  0.131376  0.869997  0.286898  1
  Sm  Sm26  1  0.146054  0.702453  0.318936  1
  Sm  Sm27  1  0.649756  0.869564  0.320481  1
  Sm  Sm28  1  0.131524  0.536322  0.286862  1
  Sm  Sm29  1  0.146469  0.369306  0.318832  1
  Sm  Sm30  1  0.631455  0.705128  0.286728  1
  Sm  Sm31  1  0.646159  0.537047  0.318751  1
  Sm  Sm32  1  0.131622  0.203248  0.286883  1
  Sm  Sm33  1  0.146181  0.036004  0.318913  1
  Sm  Sm34  1  0.631036  0.369291  0.286845  1
  Sm  Sm35  1  0.650245  0.202662  0.320505  1
  Sm  Sm36  1  0.631284  0.036947  0.287003  1
  Sm  Sm37  1  0.907909  0.707893  0.334567  1
  Sm  Sm38  1  0.889193  0.539628  0.304453  1
  Sm  Sm39  1  0.389541  0.707013  0.304095  1
  Sm  Sm40  1  0.907808  0.374682  0.334686  1
  Sm  Sm41  1  0.890256  0.206184  0.304302  1
  Sm  Sm42  1  0.407339  0.541841  0.334146  1
  Sm  Sm43  1  0.391163  0.370987  0.304578  1
  Sm  Sm44  1  0.908133  0.041234  0.334720  1
  Sm  Sm45  1  0.890313  0.872757  0.304282  1
  Sm  Sm46  1  0.406246  0.206928  0.335578  1
  Sm  Sm47  1  0.391175  0.038109  0.304654  1
  Sm  Sm48  1  0.406391  0.873632  0.335510  1
  Sm  Sm49  1  0.833554  0.786807  0.395642  1
  Sm  Sm50  1  0.804884  0.620320  0.365247  1
  Sm  Sm51  1  0.304494  0.786502  0.365435  1
  Sm  Sm52  1  0.833283  0.453684  0.395345  1
  Sm  Sm53  1  0.804116  0.286391  0.364876  1
  Sm  Sm54  1  0.332465  0.619878  0.395690  1
  Sm  Sm55  1  0.305464  0.453013  0.365209  1
  Sm  Sm56  1  0.833686  0.120090  0.395662  1
  Sm  Sm57  1  0.804306  0.953273  0.364970  1
  Sm  Sm58  1  0.332030  0.286842  0.395958  1
  Sm  Sm59  1  0.305022  0.119480  0.365334  1
  Sm  Sm60  1  0.331803  0.953319  0.396057  1
  Sm  Sm61  1  0.042605  0.787867  0.349137  1
  Sm  Sm62  1  0.070516  0.620709  0.382041  1
  Sm  Sm63  1  0.569539  0.788570  0.380788  1
  Sm  Sm64  1  0.043164  0.454496  0.349186  1
  Sm  Sm65  1  0.070456  0.287390  0.382108  1
  Sm  Sm66  1  0.541792  0.622298  0.348116  1
  Sm  Sm67  1  0.569625  0.453917  0.381102  1
  Sm  Sm68  1  0.042872  0.121296  0.349166  1
  Sm  Sm69  1  0.070332  0.954044  0.382043  1
  Sm  Sm70  1  0.594928  0.286550  0.412598  1
  Sm  Sm71  1  0.569255  0.121073  0.380657  1
  Sm  Sm72  1  0.594816  0.953719  0.412437  1
  Sm  Sm73  1  0.173548  0.866492  0.356199  1
  Sm  Sm74  1  0.200558  0.699920  0.387607  1
  Sm  Sm75  1  0.701293  0.866282  0.388256  1
  Sm  Sm76  1  0.173995  0.533017  0.356045  1
  Sm  Sm77  1  0.200586  0.366784  0.387739  1
  Sm  Sm78  1  0.673563  0.700528  0.355736  1
  Sm  Sm79  1  0.700521  0.533736  0.387280  1
  Sm  Sm80  1  0.173790  0.199852  0.356160  1
  Sm  Sm81  1  0.200452  0.033464  0.387712  1
  Sm  Sm82  1  0.672824  0.366460  0.355414  1
  Sm  Sm83  1  0.701139  0.199590  0.388225  1
  Sm  Sm84  1  0.673007  0.033218  0.355475  1
  Sm  Sm85  1  0.963827  0.706523  0.403847  1
  Sm  Sm86  1  0.938454  0.541341  0.371585  1
  Sm  Sm87  1  0.437622  0.707587  0.371760  1
  Sm  Sm88  1  0.963850  0.373354  0.403815  1
  Sm  Sm89  1  0.938236  0.208096  0.371629  1
  Sm  Sm90  1  0.463399  0.540000  0.403437  1
  Sm  Sm91  1  0.437547  0.375463  0.372864  1
  Sm  Sm92  1  0.963916  0.039945  0.403918  1
  Sm  Sm93  1  0.938128  0.874740  0.371691  1
  Sm  Sm94  1  0.463854  0.207371  0.403458  1
  Sm  Sm95  1  0.437481  0.041480  0.373084  1
  Sm  Sm96  1  0.463861  0.873761  0.403423  1
  Sm  Sm97  1  0.887238  0.786255  0.462900  1
  Sm  Sm98  1  0.860442  0.620006  0.430232  1
  Sm  Sm99  1  0.360509  0.786896  0.430190  1
  Sm  Sm100  1  0.886988  0.452855  0.462735  1
  Sm  Sm101  1  0.860306  0.286864  0.430034  1
  Sm  Sm102  1  0.387251  0.619703  0.462714  1
  Sm  Sm103  1  0.359650  0.453515  0.430785  1
  Sm  Sm104  1  0.887173  0.119626  0.462924  1
  Sm  Sm105  1  0.860365  0.953426  0.430187  1
  Sm  Sm106  1  0.387116  0.286501  0.462878  1
  Sm  Sm107  1  0.360024  0.120674  0.430506  1
  Sm  Sm108  1  0.387152  0.953249  0.462765  1
  Sm  Sm109  1  0.096515  0.786478  0.414910  1
  Sm  Sm110  1  0.124660  0.619921  0.447467  1
  Sm  Sm111  1  0.623739  0.786971  0.446391  1
  Sm  Sm112  1  0.096594  0.453268  0.414988  1
  Sm  Sm113  1  0.124441  0.286559  0.447541  1
  Sm  Sm114  1  0.595943  0.620166  0.413729  1
  Sm  Sm115  1  0.624047  0.453071  0.446364  1
  Sm  Sm116  1  0.096509  0.119877  0.414975  1
  Sm  Sm117  1  0.124380  0.953214  0.447473  1
  Sm  Sm118  1  0.650424  0.286182  0.479386  1
  Sm  Sm119  1  0.623582  0.119922  0.446235  1
  Sm  Sm120  1  0.650322  0.953063  0.479385  1
  Sm  Sm121  1  0.228035  0.867102  0.422073  1
  Sm  Sm122  1  0.255764  0.700328  0.454646  1
  Sm  Sm123  1  0.755728  0.867085  0.454318  1
  Sm  Sm124  1  0.228315  0.533828  0.421919  1
  Sm  Sm125  1  0.255428  0.366939  0.454801  1
  Sm  Sm126  1  0.728275  0.700624  0.421628  1
  Sm  Sm127  1  0.755552  0.533770  0.454137  1
  Sm  Sm128  1  0.228088  0.200453  0.422043  1
  Sm  Sm129  1  0.255457  0.033685  0.454814  1
  Sm  Sm130  1  0.727968  0.367559  0.421142  1
  Sm  Sm131  1  0.755669  0.200469  0.454186  1
  Sm  Sm132  1  0.728007  0.033888  0.421339  1
  Sm  Sm133  1  0.018691  0.705692  0.471698  1
  Sm  Sm134  1  0.991511  0.539524  0.438199  1
  Sm  Sm135  1  0.491488  0.706233  0.437905  1
  Sm  Sm136  1  0.018533  0.372335  0.471651  1
  Sm  Sm137  1  0.991406  0.206224  0.438194  1
  Sm  Sm138  1  0.518584  0.539132  0.471237  1
  Sm  Sm139  1  0.491435  0.373400  0.438415  1
  Sm  Sm140  1  0.018556  0.039057  0.471734  1
  Sm  Sm141  1  0.991462  0.872828  0.438222  1
  Sm  Sm142  1  0.518416  0.206052  0.471058  1
  Sm  Sm143  1  0.491430  0.040097  0.438438  1
  Sm  Sm144  1  0.518433  0.872641  0.470950  1
  Sm  Sm145  1  0.941017  0.786054  0.529670  1
  Sm  Sm146  1  0.914045  0.619519  0.496466  1
  Sm  Sm147  1  0.414032  0.786242  0.496525  1
  Sm  Sm148  1  0.941079  0.452614  0.529422  1
  Sm  Sm149  1  0.913859  0.286185  0.496449  1
  Sm  Sm150  1  0.441210  0.619245  0.529442  1
  Sm  Sm151  1  0.413984  0.453096  0.496825  1
  Sm  Sm152  1  0.940884  0.119465  0.529715  1
  Sm  Sm153  1  0.914012  0.952926  0.496545  1
  Sm  Sm154  1  0.441178  0.285946  0.529520  1
  Sm  Sm155  1  0.413797  0.119765  0.496833  1
  Sm  Sm156  1  0.441071  0.952553  0.529394  1
  Sm  Sm157  1  0.151213  0.786186  0.480775  1
  Sm  Sm158  1  0.178056  0.619602  0.513881  1
  Sm  Sm159  1  0.677412  0.786286  0.512846  1
  Sm  Sm160  1  0.151184  0.452916  0.480796  1
  Sm  Sm161  1  0.178031  0.286068  0.513891  1
  Sm  Sm162  1  0.650562  0.619656  0.479728  1
  Sm  Sm163  1  0.677400  0.453013  0.512842  1
  Sm  Sm164  1  0.151052  0.119478  0.480820  1
  Sm  Sm165  1  0.178002  0.952769  0.513897  1
  Sm  Sm166  1  0.704183  0.286340  0.545871  1
  Sm  Sm167  1  0.677285  0.119564  0.512727  1
  Sm  Sm168  1  0.704292  0.952691  0.545888  1
  Sm  Sm169  1  0.282586  0.866842  0.488457  1
  Sm  Sm170  1  0.309688  0.699855  0.521602  1
  Sm  Sm171  1  0.809429  0.866668  0.521239  1
  Sm  Sm172  1  0.282477  0.533664  0.488567  1
  Sm  Sm173  1  0.309585  0.366564  0.521661  1
  Sm  Sm174  1  0.782353  0.700235  0.488095  1
  Sm  Sm175  1  0.809372  0.533310  0.521168  1
  Sm  Sm176  1  0.282426  0.200213  0.488564  1
  Sm  Sm177  1  0.309483  0.033172  0.521681  1
  Sm  Sm178  1  0.782099  0.366960  0.487803  1
  Sm  Sm179  1  0.809219  0.200068  0.521179  1
  Sm  Sm180  1  0.782195  0.033626  0.487902  1
  Sm  Sm181  1  0.072929  0.705482  0.538548  1
  Sm  Sm182  1  0.045929  0.538999  0.505131  1
  Sm  Sm183  1  0.545657  0.705762  0.504705  1
  Sm  Sm184  1  0.073052  0.372046  0.538466  1
  Sm  Sm185  1  0.045740  0.205650  0.505214  1
  Sm  Sm186  1  0.572801  0.538801  0.538148  1
  Sm  Sm187  1  0.545720  0.372482  0.504790  1
  Sm  Sm188  1  0.072829  0.038728  0.538581  1
  Sm  Sm189  1  0.045817  0.872343  0.505184  1
  Sm  Sm190  1  0.572682  0.205482  0.537946  1
  Sm  Sm191  1  0.545529  0.039165  0.504735  1
  Sm  Sm192  1  0.572592  0.872101  0.537853  1
  Sm  Sm193  1  0.994422  0.785399  0.596199  1
  Sm  Sm194  1  0.967728  0.619190  0.563215  1
  Sm  Sm195  1  0.467648  0.785756  0.563280  1
  Sm  Sm196  1  0.995145  0.452054  0.595730  1
  Sm  Sm197  1  0.967717  0.286184  0.563249  1
  Sm  Sm198  1  0.494979  0.618534  0.595917  1
  Sm  Sm199  1  0.467851  0.452500  0.563479  1
  Sm  Sm200  1  0.994582  0.119183  0.596056  1
  Sm  Sm201  1  0.967557  0.952657  0.563367  1
  Sm  Sm202  1  0.495005  0.285267  0.595849  1
  Sm  Sm203  1  0.467815  0.119192  0.563464  1
  Sm  Sm204  1  0.494912  0.952004  0.595698  1
  Sm  Sm205  1  0.205100  0.786104  0.547283  1
  Sm  Sm206  1  0.231893  0.619042  0.580373  1
  Sm  Sm207  1  0.731257  0.785543  0.579302  1
  Sm  Sm208  1  0.205108  0.452689  0.547274  1
  Sm  Sm209  1  0.231579  0.285730  0.580410  1
  Sm  Sm210  1  0.704440  0.619539  0.546242  1
  Sm  Sm211  1  0.730981  0.452856  0.579313  1
  Sm  Sm212  1  0.204941  0.119374  0.547318  1
  Sm  Sm213  1  0.231741  0.952366  0.580446  1
  Sm  Sm214  1  0.758691  0.286074  0.611699  1
  Sm  Sm215  1  0.730791  0.119100  0.579090  1
  Sm  Sm216  1  0.758753  0.952138  0.611880  1
  Sm  Sm217  1  0.336636  0.866260  0.555354  1
  Sm  Sm218  1  0.363655  0.698988  0.587995  1
  Sm  Sm219  1  0.863494  0.866144  0.588154  1
  Sm  Sm220  1  0.336763  0.532984  0.555450  1
  Sm  Sm221  1  0.363596  0.365636  0.587991  1
  Sm  Sm222  1  0.836589  0.699729  0.554897  1
  Sm  Sm223  1  0.863550  0.532373  0.587719  1
  Sm  Sm224  1  0.336598  0.199678  0.555463  1
  Sm  Sm225  1  0.363573  0.032333  0.587945  1
  Sm  Sm226  1  0.836461  0.366627  0.554614  1
  Sm  Sm227  1  0.863560  0.199609  0.588164  1
  Sm  Sm228  1  0.836439  0.033361  0.554720  1
  Sm  Sm229  1  0.127366  0.705276  0.604988  1
  Sm  Sm230  1  0.099746  0.538669  0.571991  1
  Sm  Sm231  1  0.599551  0.705419  0.571546  1
  Sm  Sm232  1  0.126984  0.371854  0.605181  1
  Sm  Sm233  1  0.099390  0.205381  0.572158  1
  Sm  Sm234  1  0.627284  0.538764  0.604728  1
  Sm  Sm235  1  0.599700  0.372125  0.571692  1
  Sm  Sm236  1  0.127202  0.038578  0.605086  1
  Sm  Sm237  1  0.099488  0.871977  0.572097  1
  Sm  Sm238  1  0.627051  0.205291  0.604430  1
  Sm  Sm239  1  0.599638  0.038752  0.571557  1
  Sm  Sm240  1  0.627000  0.872230  0.604258  1
  Sm  Sm241  1  0.050761  0.785997  0.661254  1
  Sm  Sm242  1  0.022056  0.619077  0.630123  1
  Sm  Sm243  1  0.522754  0.786079  0.629926  1
  Sm  Sm244  1  0.049916  0.452941  0.661528  1
  Sm  Sm245  1  0.021151  0.285695  0.630589  1
  Sm  Sm246  1  0.550425  0.620176  0.661349  1
  Sm  Sm247  1  0.523052  0.452593  0.630232  1
  Sm  Sm248  1  0.050522  0.119236  0.661352  1
  Sm  Sm249  1  0.021743  0.952701  0.630309  1
  Sm  Sm250  1  0.549977  0.286490  0.661084  1
  Sm  Sm251  1  0.523146  0.119186  0.630221  1
  Sm  Sm252  1  0.549772  0.952911  0.660989  1
  Sm  Sm253  1  0.260396  0.785526  0.614326  1
  Sm  Sm254  1  0.285770  0.617744  0.646007  1
  Sm  Sm255  1  0.785287  0.784233  0.645043  1
  Sm  Sm256  1  0.260328  0.452071  0.614282  1
  Sm  Sm257  1  0.285814  0.284371  0.645984  1
  Sm  Sm258  1  0.759745  0.619185  0.613037  1
  Sm  Sm259  1  0.785041  0.452284  0.644762  1
  Sm  Sm260  1  0.260384  0.118807  0.614347  1
  Sm  Sm261  1  0.285807  0.951140  0.646060  1
  Sm  Sm262  1  0.812171  0.284592  0.677441  1
  Sm  Sm263  1  0.784660  0.118061  0.644407  1
  Sm  Sm264  1  0.812660  0.950168  0.677718  1
  Sm  Sm265  1  0.391003  0.865258  0.622933  1
  Sm  Sm266  1  0.417573  0.697639  0.653446  1
  Sm  Sm267  1  0.917159  0.864831  0.654295  1
  Sm  Sm268  1  0.390970  0.531810  0.623034  1
  Sm  Sm269  1  0.417365  0.364277  0.653411  1
  Sm  Sm270  1  0.890753  0.698523  0.622466  1
  Sm  Sm271  1  0.917175  0.530350  0.653360  1
  Sm  Sm272  1  0.391109  0.198510  0.623022  1
  Sm  Sm273  1  0.417437  0.030966  0.653377  1
  Sm  Sm274  1  0.891101  0.365676  0.622507  1
  Sm  Sm275  1  0.916689  0.197643  0.654771  1
  Sm  Sm276  1  0.891073  0.032597  0.622514  1
  Sm  Sm277  1  0.182045  0.705487  0.670887  1
  Sm  Sm278  1  0.153680  0.539234  0.638100  1
  Sm  Sm279  1  0.653896  0.706306  0.637854  1
  Sm  Sm280  1  0.181787  0.372358  0.670997  1
  Sm  Sm281  1  0.153632  0.206113  0.638164  1
  Sm  Sm282  1  0.681891  0.539769  0.670516  1
  Sm  Sm283  1  0.654575  0.372343  0.638703  1
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