# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   35.53750376
_cell_length_b   13.33035860
_cell_length_c   47.93715627
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   86.31325459
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm288
_cell_volume   22662.1611527
_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  0.302552  0.818601  0.319721  1
  Sm  Sm2  1  0.635886  0.485268  0.319721  1
  Sm  Sm3  1  0.636519  0.760820  0.339104  1
  Sm  Sm4  1  0.969219  0.151935  0.319721  1
  Sm  Sm5  1  0.969853  0.427487  0.339104  1
  Sm  Sm6  1  0.977965  0.853243  0.304385  1
  Sm  Sm7  1  0.303186  0.094153  0.339104  1
  Sm  Sm8  1  0.311298  0.519910  0.304385  1
  Sm  Sm9  1  0.644632  0.186577  0.304385  1
  Sm  Sm10  1  0.473154  0.786745  0.330891  1
  Sm  Sm11  1  0.806487  0.453412  0.330891  1
  Sm  Sm12  1  0.804418  0.882720  0.295683  1
  Sm  Sm13  1  0.139820  0.120079  0.330891  1
  Sm  Sm14  1  0.137751  0.549386  0.295683  1
  Sm  Sm15  1  0.137392  0.836337  0.311667  1
  Sm  Sm16  1  0.471084  0.216053  0.295683  1
  Sm  Sm17  1  0.470725  0.503004  0.311667  1
  Sm  Sm18  1  0.804059  0.169670  0.311667  1
  Sm  Sm19  1  0.558188  0.744755  0.287424  1
  Sm  Sm20  1  0.891522  0.411421  0.287424  1
  Sm  Sm21  1  0.889784  0.692865  0.304786  1
  Sm  Sm22  1  0.224855  0.078088  0.287424  1
  Sm  Sm23  1  0.223117  0.359531  0.304786  1
  Sm  Sm24  1  0.221535  0.647028  0.322840  1
  Sm  Sm25  1  0.556450  0.026198  0.304786  1
  Sm  Sm26  1  0.554868  0.313695  0.322840  1
  Sm  Sm27  1  0.888202  0.980362  0.322840  1
  Sm  Sm28  1  0.392070  0.977280  0.317190  1
  Sm  Sm29  1  0.725403  0.643946  0.317190  1
  Sm  Sm30  1  0.718681  0.930094  0.333754  1
  Sm  Sm31  1  0.058737  0.310613  0.317190  1
  Sm  Sm32  1  0.052014  0.596760  0.333754  1
  Sm  Sm33  1  0.056748  0.026610  0.303259  1
  Sm  Sm34  1  0.385347  0.263427  0.333754  1
  Sm  Sm35  1  0.390082  0.693277  0.303259  1
  Sm  Sm36  1  0.723415  0.359943  0.303259  1
  Sm  Sm37  1  0.300170  0.649825  0.376482  1
  Sm  Sm38  1  0.633503  0.316491  0.376482  1
  Sm  Sm39  1  0.630781  0.592643  0.396414  1
  Sm  Sm40  1  0.966837  0.983158  0.376482  1
  Sm  Sm41  1  0.964114  0.259310  0.396414  1
  Sm  Sm42  1  0.966424  0.699450  0.361335  1
  Sm  Sm43  1  0.297447  0.925976  0.396414  1
  Sm  Sm44  1  0.299757  0.366117  0.361335  1
  Sm  Sm45  1  0.633091  0.032784  0.361335  1
  Sm  Sm46  1  0.463749  0.618903  0.386658  1
  Sm  Sm47  1  0.797082  0.285569  0.386658  1
  Sm  Sm48  1  0.803122  0.727150  0.352994  1
  Sm  Sm49  1  0.130416  0.952236  0.386658  1
  Sm  Sm50  1  0.136455  0.393817  0.352994  1
  Sm  Sm51  1  0.133716  0.671505  0.370035  1
  Sm  Sm52  1  0.469788  0.060484  0.352994  1
  Sm  Sm53  1  0.467049  0.338172  0.370035  1
  Sm  Sm54  1  0.800382  0.004838  0.370035  1
  Sm  Sm55  1  0.552116  0.588997  0.344934  1
  Sm  Sm56  1  0.885450  0.255664  0.344934  1
  Sm  Sm57  1  0.884414  0.534498  0.363155  1
  Sm  Sm58  1  0.218783  0.922330  0.344934  1
  Sm  Sm59  1  0.217748  0.201164  0.363155  1
  Sm  Sm60  1  0.216084  0.483786  0.378272  1
  Sm  Sm61  1  0.551081  0.867831  0.363155  1
  Sm  Sm62  1  0.549417  0.150452  0.378272  1
  Sm  Sm63  1  0.882751  0.817119  0.378272  1
  Sm  Sm64  1  0.382304  0.814904  0.375287  1
  Sm  Sm65  1  0.715637  0.481571  0.375287  1
  Sm  Sm66  1  0.714148  0.758420  0.393584  1
  Sm  Sm67  1  0.048970  0.148237  0.375287  1
  Sm  Sm68  1  0.047481  0.425086  0.393584  1
  Sm  Sm69  1  0.051298  0.863264  0.358898  1
  Sm  Sm70  1  0.380815  0.091753  0.393584  1
  Sm  Sm71  1  0.384632  0.529930  0.358898  1
  Sm  Sm72  1  0.717965  0.196597  0.358898  1
  Sm  Sm73  1  0.294118  0.482071  0.432642  1
  Sm  Sm74  1  0.627451  0.148737  0.432642  1
  Sm  Sm75  1  0.625507  0.425572  0.451419  1
  Sm  Sm76  1  0.960784  0.815404  0.432642  1
  Sm  Sm77  1  0.958840  0.092238  0.451419  1
  Sm  Sm78  1  0.962150  0.533670  0.415429  1
  Sm  Sm79  1  0.292173  0.758905  0.451419  1
  Sm  Sm80  1  0.295483  0.200337  0.415429  1
  Sm  Sm81  1  0.628816  0.867004  0.415429  1
  Sm  Sm82  1  0.459136  0.453160  0.442665  1
  Sm  Sm83  1  0.792470  0.119827  0.442665  1
  Sm  Sm84  1  0.795602  0.561383  0.406308  1
  Sm  Sm85  1  0.125803  0.786493  0.442665  1
  Sm  Sm86  1  0.128936  0.228050  0.406308  1
  Sm  Sm87  1  0.128658  0.505852  0.425495  1
  Sm  Sm88  1  0.462269  0.894716  0.406308  1
  Sm  Sm89  1  0.461991  0.172519  0.425495  1
  Sm  Sm90  1  0.795324  0.839186  0.425495  1
  Sm  Sm91  1  0.547579  0.425208  0.397734  1
  Sm  Sm92  1  0.880913  0.091875  0.397734  1
  Sm  Sm93  1  0.878030  0.369997  0.416606  1
  Sm  Sm94  1  0.214246  0.758542  0.397734  1
  Sm  Sm95  1  0.211364  0.036664  0.416606  1
  Sm  Sm96  1  0.210383  0.317590  0.434174  1
  Sm  Sm97  1  0.544697  0.703331  0.416606  1
  Sm  Sm98  1  0.543717  0.984257  0.434174  1
  Sm  Sm99  1  0.877050  0.650924  0.434174  1
  Sm  Sm100  1  0.377166  0.646094  0.431563  1
  Sm  Sm101  1  0.710499  0.312760  0.431563  1
  Sm  Sm102  1  0.708659  0.590460  0.450394  1
  Sm  Sm103  1  0.043833  0.979427  0.431563  1
  Sm  Sm104  1  0.041992  0.257126  0.450394  1
  Sm  Sm105  1  0.045973  0.698174  0.413365  1
  Sm  Sm106  1  0.375326  0.923793  0.450394  1
  Sm  Sm107  1  0.379306  0.364840  0.413365  1
  Sm  Sm108  1  0.712640  0.031507  0.413365  1
  Sm  Sm109  1  0.288106  0.316211  0.488323  1
  Sm  Sm110  1  0.621439  0.982878  0.488323  1
  Sm  Sm111  1  0.619861  0.261071  0.506773  1
  Sm  Sm112  1  0.954772  0.649545  0.488323  1
  Sm  Sm113  1  0.953194  0.927737  0.506773  1
  Sm  Sm114  1  0.956714  0.370278  0.470254  1
  Sm  Sm115  1  0.286527  0.594404  0.506773  1
  Sm  Sm116  1  0.290048  0.036945  0.470254  1
  Sm  Sm117  1  0.623381  0.703611  0.470254  1
  Sm  Sm118  1  0.453581  0.287838  0.498366  1
  Sm  Sm119  1  0.786914  0.954505  0.498366  1
  Sm  Sm120  1  0.790775  0.397030  0.461321  1
  Sm  Sm121  1  0.120247  0.621171  0.498366  1
  Sm  Sm122  1  0.124108  0.063697  0.461321  1
  Sm  Sm123  1  0.122493  0.341736  0.480125  1
  Sm  Sm124  1  0.457441  0.730363  0.461321  1
  Sm  Sm125  1  0.455827  0.008403  0.480125  1
  Sm  Sm126  1  0.789160  0.675070  0.480125  1
  Sm  Sm127  1  0.541775  0.262174  0.452747  1
  Sm  Sm128  1  0.875108  0.928841  0.452747  1
  Sm  Sm129  1  0.873395  0.206133  0.471513  1
  Sm  Sm130  1  0.208442  0.595508  0.452747  1
  Sm  Sm131  1  0.206728  0.872799  0.471513  1
  Sm  Sm132  1  0.204687  0.151795  0.489877  1
  Sm  Sm133  1  0.540061  0.539466  0.471513  1
  Sm  Sm134  1  0.538021  0.818461  0.489877  1
  Sm  Sm135  1  0.871354  0.485128  0.489877  1
  Sm  Sm136  1  0.371558  0.479577  0.487217  1
  Sm  Sm137  1  0.704891  0.146244  0.487217  1
  Sm  Sm138  1  0.703129  0.424333  0.505914  1
  Sm  Sm139  1  0.038225  0.812911  0.487217  1
  Sm  Sm140  1  0.036462  0.091000  0.505914  1
  Sm  Sm141  1  0.040221  0.534226  0.468797  1
  Sm  Sm142  1  0.369796  0.757666  0.505914  1
  Sm  Sm143  1  0.373554  0.200892  0.468797  1
  Sm  Sm144  1  0.706888  0.867559  0.468797  1
  Sm  Sm145  1  0.282532  0.151071  0.543590  1
  Sm  Sm146  1  0.615865  0.817737  0.543590  1
  Sm  Sm147  1  0.614282  0.097327  0.561810  1
  Sm  Sm148  1  0.949198  0.484404  0.543590  1
  Sm  Sm149  1  0.947615  0.763994  0.561810  1
  Sm  Sm150  1  0.951256  0.205615  0.525405  1
  Sm  Sm151  1  0.280949  0.430660  0.561810  1
  Sm  Sm152  1  0.284589  0.872281  0.525405  1
  Sm  Sm153  1  0.617922  0.538948  0.525405  1
  Sm  Sm154  1  0.448022  0.123795  0.553636  1
  Sm  Sm155  1  0.781355  0.790462  0.553636  1
  Sm  Sm156  1  0.785416  0.232171  0.516639  1
  Sm  Sm157  1  0.114689  0.457128  0.553636  1
  Sm  Sm158  1  0.118750  0.898838  0.516639  1
  Sm  Sm159  1  0.116748  0.177385  0.535176  1
  Sm  Sm160  1  0.452083  0.565505  0.516639  1
  Sm  Sm161  1  0.450081  0.844051  0.535176  1
  Sm  Sm162  1  0.783414  0.510718  0.535176  1
  Sm  Sm163  1  0.536035  0.097249  0.508132  1
  Sm  Sm164  1  0.869368  0.763915  0.508132  1
  Sm  Sm165  1  0.867688  0.040984  0.526693  1
  Sm  Sm166  1  0.202702  0.430582  0.508132  1
  Sm  Sm167  1  0.201021  0.707651  0.526693  1
  Sm  Sm168  1  0.199089  0.986969  0.545087  1
  Sm  Sm169  1  0.534354  0.374318  0.526693  1
  Sm  Sm170  1  0.532423  0.653636  0.545087  1
  Sm  Sm171  1  0.865756  0.320303  0.545087  1
  Sm  Sm172  1  0.365692  0.314894  0.542743  1
  Sm  Sm173  1  0.699025  0.981561  0.542743  1
  Sm  Sm174  1  0.698084  0.259335  0.561451  1
  Sm  Sm175  1  0.032359  0.648228  0.542743  1
  Sm  Sm176  1  0.031417  0.926001  0.561451  1
  Sm  Sm177  1  0.034671  0.369446  0.524503  1
  Sm  Sm178  1  0.364750  0.592668  0.561451  1
  Sm  Sm179  1  0.368004  0.036113  0.524503  1
  Sm  Sm180  1  0.701338  0.702779  0.524503  1
  Sm  Sm181  1  0.276894  0.986461  0.598808  1
  Sm  Sm182  1  0.610227  0.653128  0.598808  1
  Sm  Sm183  1  0.609482  0.933552  0.616262  1
  Sm  Sm184  1  0.943561  0.319794  0.598808  1
  Sm  Sm185  1  0.942815  0.600218  0.616262  1
  Sm  Sm186  1  0.945532  0.039124  0.580935  1
  Sm  Sm187  1  0.276149  0.266885  0.616262  1
  Sm  Sm188  1  0.278866  0.705791  0.580935  1
  Sm  Sm189  1  0.612199  0.372457  0.580935  1
  Sm  Sm190  1  0.442545  0.959874  0.608331  1
  Sm  Sm191  1  0.775878  0.626541  0.608331  1
  Sm  Sm192  1  0.779837  0.065930  0.572430  1
  Sm  Sm193  1  0.109212  0.293207  0.608331  1
  Sm  Sm194  1  0.113170  0.732597  0.572430  1
  Sm  Sm195  1  0.111642  0.012615  0.590691  1
  Sm  Sm196  1  0.446504  0.399263  0.572430  1
  Sm  Sm197  1  0.444975  0.679282  0.590691  1
  Sm  Sm198  1  0.778309  0.345948  0.590691  1
  Sm  Sm199  1  0.530552  0.932509  0.563551  1
  Sm  Sm200  1  0.863886  0.599176  0.563551  1
  Sm  Sm201  1  0.862197  0.874434  0.582812  1
  Sm  Sm202  1  0.197219  0.265842  0.563551  1
  Sm  Sm203  1  0.195530  0.541100  0.582812  1
  Sm  Sm204  1  0.193740  0.821792  0.599843  1
  Sm  Sm205  1  0.528863  0.207767  0.582812  1
  Sm  Sm206  1  0.527073  0.488459  0.599843  1
  Sm  Sm207  1  0.860406  0.155126  0.599843  1
  Sm  Sm208  1  0.360756  0.151304  0.598401  1
  Sm  Sm209  1  0.694090  0.817971  0.598401  1
  Sm  Sm210  1  0.691384  0.096177  0.616765  1
  Sm  Sm211  1  0.027423  0.484637  0.598401  1
  Sm  Sm212  1  0.024718  0.762843  0.616765  1
  Sm  Sm213  1  0.029147  0.203732  0.580024  1
  Sm  Sm214  1  0.358051  0.429510  0.616765  1
  Sm  Sm215  1  0.362481  0.870398  0.580024  1
  Sm  Sm216  1  0.695814  0.537065  0.580024  1
  Sm  Sm217  1  0.272869  0.824317  0.653420  1
  Sm  Sm218  1  0.606202  0.490983  0.653420  1
  Sm  Sm219  1  0.602393  0.768415  0.670623  1
  Sm  Sm220  1  0.939536  0.157650  0.653420  1
  Sm  Sm221  1  0.935726  0.435082  0.670623  1
  Sm  Sm222  1  0.939367  0.873532  0.637520  1
  Sm  Sm223  1  0.269060  0.101749  0.670623  1
  Sm  Sm224  1  0.272700  0.540198  0.637520  1
  Sm  Sm225  1  0.606034  0.206865  0.637520  1
  Sm  Sm226  1  0.436496  0.792178  0.662744  1
  Sm  Sm227  1  0.769829  0.458844  0.662744  1
  Sm  Sm228  1  0.775513  0.898600  0.629153  1
  Sm  Sm229  1  0.103163  0.125511  0.662744  1
  Sm  Sm230  1  0.108846  0.565267  0.629153  1
  Sm  Sm231  1  0.103998  0.846935  0.644851  1
  Sm  Sm232  1  0.442180  0.231933  0.629153  1
  Sm  Sm233  1  0.437332  0.513602  0.644851  1
  Sm  Sm234  1  0.770665  0.180269  0.644851  1
  Sm  Sm235  1  0.525059  0.768665  0.618739  1
  Sm  Sm236  1  0.858393  0.435331  0.618739  1
  Sm  Sm237  1  0.856500  0.703644  0.640052  1
  Sm  Sm238  1  0.191726  0.101998  0.618739  1
  Sm  Sm239  1  0.189834  0.370310  0.640052  1
  Sm  Sm240  1  0.188983  0.656346  0.654339  1
  Sm  Sm241  1  0.523167  0.036977  0.640052  1
  Sm  Sm242  1  0.522316  0.323013  0.654339  1
  Sm  Sm243  1  0.855649  0.989680  0.654339  1
  Sm  Sm244  1  0.355208  0.985723  0.652123  1
  Sm  Sm245  1  0.688542  0.652389  0.652123  1
  Sm  Sm246  1  0.689382  0.932982  0.671495  1
  Sm  Sm247  1  0.021875  0.319056  0.652123  1
  Sm  Sm248  1  0.022716  0.599649  0.671495  1
  Sm  Sm249  1  0.021886  0.039263  0.635232  1
  Sm  Sm250  1  0.356049  0.266315  0.671495  1
  Sm  Sm251  1  0.355220  0.705929  0.635232  1
  Sm  Sm252  1  0.688553  0.372596  0.635232  1
  Sm  Sm253  1  0.261774  0.667538  0.709364  1
  Sm  Sm254  1  0.595107  0.334205  0.709364  1
  Sm  Sm255  1  0.580731  0.609211  0.728436  1
  Sm  Sm256  1  0.928441  0.000871  0.709364  1
  Sm  Sm257  1  0.914064  0.275878  0.728436  1
  Sm  Sm258  1  0.937827  0.704462  0.693513  1
  Sm  Sm259  1  0.247397  0.942545  0.728436  1
  Sm  Sm260  1  0.271161  0.371129  0.693513  1
  Sm  Sm261  1  0.604494  0.037796  0.693513  1
  Sm  Sm262  1  0.449421  0.633847  0.722476  1
  Sm  Sm263  1  0.782754  0.300514  0.722476  1
  Sm  Sm264  1  0.765578  0.731879  0.686263  1
  Sm  Sm265  1  0.116087  0.967181  0.722476  1
  Sm  Sm266  1  0.098911  0.398545  0.686263  1
  Sm  Sm267  1  0.110035  0.690938  0.703536  1
  Sm  Sm268  1  0.432244  0.065212  0.686263  1
  Sm  Sm269  1  0.443369  0.357605  0.703536  1
  Sm  Sm270  1  0.776702  0.024271  0.703536  1
  Sm  Sm271  1  0.519571  0.594064  0.672839  1
  Sm  Sm272  1  0.852905  0.260731  0.672839  1
  Sm  Sm273  1  0.849716  0.537396  0.700025  1
  Sm  Sm274  1  0.186238  0.927398  0.672839  1
  Sm  Sm275  1  0.183049  0.204063  0.700025  1
  Sm  Sm276  1  0.183785  0.493684  0.711042  1
  Sm  Sm277  1  0.516382  0.870729  0.700025  1
  Sm  Sm278  1  0.517118  0.160350  0.711042  1
  Sm  Sm279  1  0.850451  0.827017  0.711042  1
  Sm  Sm280  1  0.351122  0.821260  0.710322  1
  Sm  Sm281  1  0.684455  0.487927  0.710322  1
  Sm  Sm282  1  0.672070  0.762783  0.726950  1
  Sm  Sm283  1  0.017789  0.154593  0.710322  1
  Sm  Sm284  1  0.005404  0.429450  0.726950  1
  Sm  Sm285  1  0.021437  0.875931  0.692818  1
  Sm  Sm286  1  0.338737  0.096116  0.726950  1
  Sm  Sm287  1  0.354770  0.542598  0.692818  1
  Sm  Sm288  1  0.688104  0.209264  0.692818  1
