# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.47582206
_cell_length_b   28.60644547
_cell_length_c   50.26032450
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   93.77022963
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm63
_cell_volume   4986.61442369
_cell_formula_units_Z   63
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  0.564313  0.504234  0.278026  1
  Sm  Sm2  1  0.125037  0.622992  0.271306  1
  Sm  Sm3  1  0.657070  0.690329  0.324657  1
  Sm  Sm4  1  0.216855  0.808186  0.317258  1
  Sm  Sm5  1  0.278900  0.933441  0.257815  1
  Sm  Sm6  1  0.829292  0.033010  0.302961  1
  Sm  Sm7  1  0.389687  0.152092  0.299635  1
  Sm  Sm8  1  0.949071  0.269561  0.291942  1
  Sm  Sm9  1  1.001925  0.385959  0.283128  1
  Sm  Sm10  1  0.039230  0.455548  0.340109  1
  Sm  Sm11  1  0.599219  0.573290  0.333397  1
  Sm  Sm12  1  0.130574  0.639851  0.386684  1
  Sm  Sm13  1  0.689861  0.757165  0.380798  1
  Sm  Sm14  1  0.773262  0.921554  0.319852  1
  Sm  Sm15  1  0.306205  0.991045  0.368952  1
  Sm  Sm16  1  0.864032  0.106093  0.361932  1
  Sm  Sm17  1  0.422554  0.222193  0.354997  1
  Sm  Sm18  1  0.479420  0.338184  0.346020  1
  Sm  Sm19  1  0.513413  0.406234  0.402395  1
  Sm  Sm20  1  0.073285  0.523734  0.395923  1
  Sm  Sm21  1  0.604502  0.590144  0.448984  1
  Sm  Sm22  1  0.163876  0.707224  0.443255  1
  Sm  Sm23  1  0.248192  0.872783  0.378095  1
  Sm  Sm24  1  0.779932  0.940375  0.430675  1
  Sm  Sm25  1  0.339180  0.057535  0.424628  1
  Sm  Sm26  1  0.898093  0.174137  0.418097  1
  Sm  Sm27  1  0.953915  0.289150  0.408547  1
  Sm  Sm28  1  0.987894  0.356988  0.464916  1
  Sm  Sm29  1  0.547477  0.474169  0.458360  1
  Sm  Sm30  1  0.078602  0.540477  0.511184  1
  Sm  Sm31  1  0.638065  0.657681  0.505406  1
  Sm  Sm32  1  0.723017  0.823678  0.438897  1
  Sm  Sm33  1  0.254092  0.890377  0.492551  1
  Sm  Sm34  1  0.813428  0.007777  0.487022  1
  Sm  Sm35  1  0.372547  0.124837  0.480906  1
  Sm  Sm36  1  0.428666  0.240124  0.471424  1
  Sm  Sm37  1  0.462289  0.307934  0.527593  1
  Sm  Sm38  1  1.021737  0.424802  0.520928  1
  Sm  Sm39  1  0.553052  0.491162  0.573576  1
  Sm  Sm40  1  0.112229  0.608129  0.567162  1
  Sm  Sm41  1  0.197251  0.774260  0.500703  1
  Sm  Sm42  1  0.728215  0.840304  0.554636  1
  Sm  Sm43  1  0.287711  0.957700  0.549138  1
  Sm  Sm44  1  0.847149  0.075158  0.543473  1
  Sm  Sm45  1  0.902999  0.190854  0.534231  1
  Sm  Sm46  1  0.936722  0.259053  0.590206  1
  Sm  Sm47  1  0.496216  0.376082  0.583864  1
  Sm  Sm48  1  0.028675  0.444227  0.636824  1
  Sm  Sm49  1  0.586630  0.559726  0.629020  1
  Sm  Sm50  1  0.671238  0.724640  0.562788  1
  Sm  Sm51  1  0.201861  0.789643  0.617063  1
  Sm  Sm52  1  0.761575  0.907209  0.611123  1
  Sm  Sm53  1  0.321481  0.024973  0.605691  1
  Sm  Sm54  1  0.377448  0.141545  0.597031  1
  Sm  Sm55  1  0.410525  0.210771  0.652694  1
  Sm  Sm56  1  0.970783  0.328233  0.646680  1
  Sm  Sm57  1  0.505023  0.400040  0.699376  1
  Sm  Sm58  1  0.065674  0.518978  0.691043  1
  Sm  Sm59  1  0.144584  0.674026  0.624641  1
  Sm  Sm60  1  0.674472  0.736468  0.679082  1
  Sm  Sm61  1  0.235859  0.856477  0.672909  1
  Sm  Sm62  1  0.798851  0.975723  0.668292  1
  Sm  Sm63  1  0.850751  0.092857  0.659873  1
