# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   23.83510068
_cell_length_b   6.15925205
_cell_length_c   48.27151692
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   82.82945117
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm88
_cell_volume   7031.1431911
_cell_formula_units_Z   88
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  0.950157  0.596912  0.314399  1
  Sm  Sm2  1  0.462179  0.823765  0.294792  1
  Sm  Sm3  1  0.207625  0.921229  0.285893  1
  Sm  Sm4  1  0.699342  0.716014  0.304213  1
  Sm  Sm5  1  0.336973  0.464204  0.282325  1
  Sm  Sm6  1  0.828039  0.243188  0.301426  1
  Sm  Sm7  1  0.087776  0.386401  0.288623  1
  Sm  Sm8  1  0.580294  0.208349  0.302409  1
  Sm  Sm9  1  0.945388  0.121483  0.354941  1
  Sm  Sm10  1  0.450191  0.346072  0.336870  1
  Sm  Sm11  1  0.206126  0.452832  0.327683  1
  Sm  Sm12  1  0.698142  0.234018  0.346562  1
  Sm  Sm13  1  0.329091  0.002785  0.323907  1
  Sm  Sm14  1  0.821203  0.782631  0.343431  1
  Sm  Sm15  1  0.075638  0.912336  0.328293  1
  Sm  Sm16  1  0.572865  0.698082  0.347628  1
  Sm  Sm17  1  0.940687  0.659281  0.395193  1
  Sm  Sm18  1  0.442412  0.881506  0.377006  1
  Sm  Sm19  1  0.193805  0.998895  0.366250  1
  Sm  Sm20  1  0.692004  0.767322  0.386613  1
  Sm  Sm21  1  0.320894  0.556487  0.362699  1
  Sm  Sm22  1  0.817833  0.329357  0.381860  1
  Sm  Sm23  1  0.068288  0.447316  0.368453  1
  Sm  Sm24  1  0.566299  0.217380  0.388425  1
  Sm  Sm25  1  0.934088  0.196594  0.434584  1
  Sm  Sm26  1  0.436842  0.421072  0.415604  1
  Sm  Sm27  1  0.187855  0.538605  0.405707  1
  Sm  Sm28  1  0.685036  0.307908  0.425167  1
  Sm  Sm29  1  0.313463  0.100812  0.401537  1
  Sm  Sm30  1  0.811082  0.872408  0.421043  1
  Sm  Sm31  1  0.062818  0.983214  0.408612  1
  Sm  Sm32  1  0.559512  0.751457  0.428263  1
  Sm  Sm33  1  0.927220  0.734828  0.474362  1
  Sm  Sm34  1  0.429976  0.962492  0.455046  1
  Sm  Sm35  1  0.181840  0.077717  0.445203  1
  Sm  Sm36  1  0.678475  0.848152  0.464533  1
  Sm  Sm37  1  0.307502  0.639540  0.441376  1
  Sm  Sm38  1  0.804343  0.410517  0.460720  1
  Sm  Sm39  1  0.056403  0.520202  0.448597  1
  Sm  Sm40  1  0.553037  0.288127  0.468132  1
  Sm  Sm41  1  0.920642  0.273329  0.514041  1
  Sm  Sm42  1  0.423555  0.501848  0.494511  1
  Sm  Sm43  1  0.175277  0.618157  0.484750  1
  Sm  Sm44  1  0.672199  0.387298  0.504080  1
  Sm  Sm45  1  0.300661  0.178315  0.481069  1
  Sm  Sm46  1  0.797802  0.948176  0.500297  1
  Sm  Sm47  1  0.049763  0.058467  0.488330  1
  Sm  Sm48  1  0.546175  0.826097  0.507688  1
  Sm  Sm49  1  0.914217  0.811488  0.553658  1
  Sm  Sm50  1  0.416885  0.041673  0.533926  1
  Sm  Sm51  1  0.168734  0.157946  0.524314  1
  Sm  Sm52  1  0.664984  0.925959  0.543258  1
  Sm  Sm53  1  0.294189  0.716558  0.520782  1
  Sm  Sm54  1  0.791268  0.486818  0.540101  1
  Sm  Sm55  1  0.043480  0.596983  0.528101  1
  Sm  Sm56  1  0.539870  0.363895  0.547476  1
  Sm  Sm57  1  0.906524  0.350745  0.593389  1
  Sm  Sm58  1  0.410129  0.582179  0.573456  1
  Sm  Sm59  1  0.162325  0.699420  0.563845  1
  Sm  Sm60  1  0.660155  0.463904  0.583150  1
  Sm  Sm61  1  0.287638  0.253795  0.560732  1
  Sm  Sm62  1  0.784764  0.021744  0.579546  1
  Sm  Sm63  1  0.036401  0.136038  0.567977  1
  Sm  Sm64  1  0.533146  0.902401  0.587252  1
  Sm  Sm65  1  0.903978  0.891214  0.632817  1
  Sm  Sm66  1  0.405259  0.121427  0.612282  1
  Sm  Sm67  1  0.155615  0.240348  0.602656  1
  Sm  Sm68  1  0.650267  0.005493  0.621073  1
  Sm  Sm69  1  0.281088  0.788560  0.600649  1
  Sm  Sm70  1  0.779022  0.561611  0.620185  1
  Sm  Sm71  1  0.029942  0.679359  0.607400  1
  Sm  Sm72  1  0.525441  0.450052  0.625836  1
  Sm  Sm73  1  0.895775  0.419186  0.673091  1
  Sm  Sm74  1  0.398610  0.663002  0.652323  1
  Sm  Sm75  1  0.149016  0.775482  0.642794  1
  Sm  Sm76  1  0.644517  0.539221  0.661218  1
  Sm  Sm77  1  0.275875  0.310942  0.641521  1
  Sm  Sm78  1  0.770149  0.077851  0.656890  1
  Sm  Sm79  1  0.026461  0.228858  0.646024  1
  Sm  Sm80  1  0.524863  0.996240  0.666109  1
  Sm  Sm81  1  0.855490  0.950237  0.713194  1
  Sm  Sm82  1  0.391160  0.184258  0.693485  1
  Sm  Sm83  1  0.148916  0.297864  0.684748  1
  Sm  Sm84  1  0.657289  0.045221  0.705103  1
  Sm  Sm85  1  0.268823  0.807269  0.685900  1
  Sm  Sm86  1  0.760680  0.534841  0.705741  1
  Sm  Sm87  1  0.015212  0.768746  0.688447  1
  Sm  Sm88  1  0.516900  0.522855  0.706443  1
