# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.80708501
_cell_length_b   14.96857139
_cell_length_c   49.24572493
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   86.25991244
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm36
_cell_volume   2800.37070486
_cell_formula_units_Z   36
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  0.074592  0.185109  0.312931  1
  Sm  Sm2  1  0.811368  0.759928  0.288891  1
  Sm  Sm3  1  0.624131  0.381415  0.335564  1
  Sm  Sm4  1  0.531499  0.993169  0.286862  1
  Sm  Sm5  1  0.690322  0.066131  0.363665  1
  Sm  Sm6  1  0.346704  0.615551  0.335262  1
  Sm  Sm7  1  0.240963  0.253520  0.386413  1
  Sm  Sm8  1  0.169017  0.878786  0.340481  1
  Sm  Sm9  1  0.328534  0.932937  0.412628  1
  Sm  Sm10  1  0.000386  0.499218  0.389747  1
  Sm  Sm11  1  0.866619  0.123138  0.436484  1
  Sm  Sm12  1  0.775794  0.743092  0.386666  1
  Sm  Sm13  1  0.938690  0.809695  0.462525  1
  Sm  Sm14  1  0.623589  0.370092  0.437950  1
  Sm  Sm15  1  0.485927  0.996818  0.486684  1
  Sm  Sm16  1  0.395325  0.622185  0.438458  1
  Sm  Sm17  1  0.562955  0.681041  0.511812  1
  Sm  Sm18  1  0.249977  0.243224  0.487276  1
  Sm  Sm19  1  0.108516  0.869765  0.536509  1
  Sm  Sm20  1  0.015539  0.492211  0.487542  1
  Sm  Sm21  1  0.184272  0.551618  0.561046  1
  Sm  Sm22  1  0.873200  0.117352  0.537258  1
  Sm  Sm23  1  0.729969  0.740115  0.585025  1
  Sm  Sm24  1  0.639569  0.364034  0.537616  1
  Sm  Sm25  1  0.811456  0.427066  0.611375  1
  Sm  Sm26  1  0.497846  0.991429  0.587271  1
  Sm  Sm27  1  0.355638  0.615105  0.634784  1
  Sm  Sm28  1  0.259620  0.237403  0.588038  1
  Sm  Sm29  1  0.435822  0.303524  0.660953  1
  Sm  Sm30  1  0.117335  0.858681  0.634691  1
  Sm  Sm31  1  -0.007347  0.492929  0.686906  1
  Sm  Sm32  1  0.878822  0.109739  0.638686  1
  Sm  Sm33  1  0.047358  0.172366  0.710216  1
  Sm  Sm34  1  0.747470  0.734233  0.688479  1
  Sm  Sm35  1  0.547324  0.364145  0.736595  1
  Sm  Sm36  1  0.494754  0.974024  0.688216  1
