# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.32770244
_cell_length_b   17.27350068
_cell_length_c   53.50718776
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   92.30496440
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm108
_cell_volume   8614.21380491
_cell_formula_units_Z   108
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  0.505799  0.435288  0.251386  1
  Sm  Sm2  1  0.562510  0.044429  0.296175  1
  Sm  Sm3  1  0.543171  0.776566  0.274627  1
  Sm  Sm4  1  0.839132  0.101954  0.251386  1
  Sm  Sm5  1  0.895844  0.711095  0.296175  1
  Sm  Sm6  1  0.172466  0.768621  0.251386  1
  Sm  Sm7  1  0.876504  0.443233  0.274627  1
  Sm  Sm8  1  0.229177  0.377762  0.296175  1
  Sm  Sm9  1  0.209837  0.109900  0.274627  1
  Sm  Sm10  1  0.591592  0.244570  0.276891  1
  Sm  Sm11  1  0.650980  0.874582  0.328269  1
  Sm  Sm12  1  0.616526  0.571783  0.301189  1
  Sm  Sm13  1  0.924925  0.911237  0.276891  1
  Sm  Sm14  1  0.984313  0.541249  0.328269  1
  Sm  Sm15  1  0.258259  0.577904  0.276891  1
  Sm  Sm16  1  0.949860  0.238450  0.301189  1
  Sm  Sm17  1  0.317647  0.207916  0.328269  1
  Sm  Sm18  1  0.283193  0.905116  0.301189  1
  Sm  Sm19  1  0.576741  0.383985  0.322202  1
  Sm  Sm20  1  0.583257  0.017343  0.368425  1
  Sm  Sm21  1  0.577614  0.696279  0.346605  1
  Sm  Sm22  1  0.910074  0.050652  0.322202  1
  Sm  Sm23  1  0.916590  0.684010  0.368425  1
  Sm  Sm24  1  0.243407  0.717318  0.322202  1
  Sm  Sm25  1  0.910947  0.362946  0.346605  1
  Sm  Sm26  1  0.249923  0.350677  0.368425  1
  Sm  Sm27  1  0.244281  0.029612  0.346605  1
  Sm  Sm28  1  0.662983  0.193233  0.348654  1
  Sm  Sm29  1  0.682244  0.829495  0.397007  1
  Sm  Sm30  1  0.669228  0.511750  0.373704  1
  Sm  Sm31  1  0.996317  0.859900  0.348654  1
  Sm  Sm32  1  1.015578  0.496162  0.397007  1
  Sm  Sm33  1  0.329650  0.526566  0.348654  1
  Sm  Sm34  1  1.002561  0.178416  0.373704  1
  Sm  Sm35  1  0.348911  0.162828  0.397007  1
  Sm  Sm36  1  0.335895  0.845083  0.373704  1
  Sm  Sm37  1  0.593961  0.330064  0.391752  1
  Sm  Sm38  1  0.615121  0.965268  0.439109  1
  Sm  Sm39  1  0.605477  0.648964  0.415900  1
  Sm  Sm40  1  0.927294  0.996731  0.391752  1
  Sm  Sm41  1  0.948454  0.631935  0.439109  1
  Sm  Sm42  1  0.260628  0.663397  0.391752  1
  Sm  Sm43  1  0.938810  0.315631  0.415900  1
  Sm  Sm44  1  0.281787  0.298601  0.439109  1
  Sm  Sm45  1  0.272143  0.982297  0.415900  1
  Sm  Sm46  1  0.692919  0.144932  0.420253  1
  Sm  Sm47  1  0.713706  0.778678  0.467417  1
  Sm  Sm48  1  0.703319  0.462227  0.443475  1
  Sm  Sm49  1  0.026252  0.811599  0.420253  1
  Sm  Sm50  1  0.047039  0.445344  0.467417  1
  Sm  Sm51  1  0.359586  0.478265  0.420253  1
  Sm  Sm52  1  0.036652  0.128894  0.443475  1
  Sm  Sm53  1  0.380373  0.112011  0.467417  1
  Sm  Sm54  1  0.369985  0.795561  0.443475  1
  Sm  Sm55  1  0.625808  0.282046  0.462171  1
  Sm  Sm56  1  0.646595  0.915792  0.509334  1
  Sm  Sm57  1  0.636195  0.598497  0.486113  1
  Sm  Sm58  1  0.959141  0.948713  0.462171  1
  Sm  Sm59  1  0.979928  0.582459  0.509334  1
  Sm  Sm60  1  0.292475  0.615380  0.462171  1
  Sm  Sm61  1  0.969529  0.265163  0.486113  1
  Sm  Sm62  1  0.313262  0.249125  0.509334  1
  Sm  Sm63  1  0.302862  0.931830  0.486113  1
  Sm  Sm64  1  0.724393  0.095456  0.490478  1
  Sm  Sm65  1  0.745553  0.730660  0.537836  1
  Sm  Sm66  1  0.734038  0.411760  0.513687  1
  Sm  Sm67  1  0.057727  0.762123  0.490478  1
  Sm  Sm68  1  0.078886  0.397327  0.537836  1
  Sm  Sm69  1  0.391060  0.428789  0.490478  1
  Sm  Sm70  1  0.067371  0.078427  0.513687  1
  Sm  Sm71  1  0.412220  0.063993  0.537836  1
  Sm  Sm72  1  0.400704  0.745093  0.513687  1
  Sm  Sm73  1  0.657270  0.231229  0.532580  1
  Sm  Sm74  1  0.676531  0.867491  0.580934  1
  Sm  Sm75  1  0.670286  0.548974  0.555883  1
  Sm  Sm76  1  0.990603  0.897896  0.532580  1
  Sm  Sm77  1  1.009864  0.534158  0.580934  1
  Sm  Sm78  1  0.323937  0.564562  0.532580  1
  Sm  Sm79  1  1.003619  0.215641  0.555883  1
  Sm  Sm80  1  0.343197  0.200824  0.580934  1
  Sm  Sm81  1  0.336953  0.882308  0.555883  1
  Sm  Sm82  1  0.756257  0.043381  0.561163  1
  Sm  Sm83  1  0.762773  0.676739  0.607386  1
  Sm  Sm84  1  0.761900  0.364445  0.582982  1
  Sm  Sm85  1  0.089591  0.710047  0.561163  1
  Sm  Sm86  1  0.096107  0.343406  0.607386  1
  Sm  Sm87  1  0.422924  0.376714  0.561163  1
  Sm  Sm88  1  0.095233  0.031112  0.582982  1
  Sm  Sm89  1  0.429440  0.010072  0.607386  1
  Sm  Sm90  1  0.428567  0.697778  0.582982  1
  Sm  Sm91  1  0.688534  0.186142  0.601318  1
  Sm  Sm92  1  0.747922  0.816154  0.652697  1
  Sm  Sm93  1  0.722988  0.488941  0.628398  1
  Sm  Sm94  1  1.021867  0.852808  0.601318  1
  Sm  Sm95  1  0.081255  0.482820  0.652697  1
  Sm  Sm96  1  0.355201  0.519475  0.601318  1
  Sm  Sm97  1  0.056321  0.155608  0.628398  1
  Sm  Sm98  1  0.414589  0.149487  0.652697  1
  Sm  Sm99  1  0.389654  0.822274  0.628398  1
  Sm  Sm100  1  0.777004  0.016295  0.633412  1
  Sm  Sm101  1  0.833715  0.625436  0.678201  1
  Sm  Sm102  1  0.796344  0.284158  0.654961  1
  Sm  Sm103  1  0.110337  0.682962  0.633412  1
  Sm  Sm104  1  0.167048  0.292103  0.678201  1
  Sm  Sm105  1  0.443670  0.349629  0.633412  1
  Sm  Sm106  1  0.129677  0.950824  0.654961  1
  Sm  Sm107  1  0.500382  0.958770  0.678201  1
  Sm  Sm108  1  0.463010  0.617491  0.654961  1
