# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.32721260
_cell_length_b   6.17281561
_cell_length_c   47.69811246
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   76.00718827
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm44
_cell_volume   3521.81941498
_cell_formula_units_Z   44
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  0.800325  0.696684  0.312902  1
  Sm  Sm2  1  0.311689  0.908902  0.293740  1
  Sm  Sm3  1  0.566023  0.390241  0.294958  1
  Sm  Sm4  1  0.078406  0.428159  0.291820  1
  Sm  Sm5  1  0.775725  0.231884  0.353816  1
  Sm  Sm6  1  0.297838  0.446947  0.336299  1
  Sm  Sm7  1  0.537354  0.942277  0.337251  1
  Sm  Sm8  1  0.040252  0.964394  0.331521  1
  Sm  Sm9  1  0.753313  0.777947  0.394029  1
  Sm  Sm10  1  0.261780  1.000952  0.374534  1
  Sm  Sm11  1  0.515362  0.502643  0.375771  1
  Sm  Sm12  1  0.014252  0.505528  0.371935  1
  Sm  Sm13  1  0.727407  0.324500  0.433326  1
  Sm  Sm14  1  0.238411  0.548717  0.414072  1
  Sm  Sm15  1  0.488101  0.054395  0.414731  1
  Sm  Sm16  1  0.990262  0.049317  0.412098  1
  Sm  Sm17  1  0.701090  0.872479  0.473087  1
  Sm  Sm18  1  0.213373  0.096610  0.453399  1
  Sm  Sm19  1  0.463049  0.601553  0.454622  1
  Sm  Sm20  1  0.964832  0.595177  0.452088  1
  Sm  Sm21  1  0.675200  0.420546  0.512704  1
  Sm  Sm22  1  0.188217  0.645836  0.493102  1
  Sm  Sm23  1  0.437052  0.149001  0.494091  1
  Sm  Sm24  1  0.938317  0.142926  0.491711  1
  Sm  Sm25  1  0.649827  0.967831  0.552376  1
  Sm  Sm26  1  0.161090  0.194078  0.532298  1
  Sm  Sm27  1  0.411694  0.697221  0.534019  1
  Sm  Sm28  1  0.913852  0.690194  0.531519  1
  Sm  Sm29  1  0.622554  0.515391  0.592179  1
  Sm  Sm30  1  0.139357  0.741106  0.572467  1
  Sm  Sm31  1  0.385718  0.241357  0.573452  1
  Sm  Sm32  1  0.886534  0.238947  0.571482  1
  Sm  Sm33  1  0.603832  0.066042  0.631755  1
  Sm  Sm34  1  0.107274  0.293121  0.610381  1
  Sm  Sm35  1  0.362764  0.790983  0.614217  1
  Sm  Sm36  1  0.859084  0.794684  0.610283  1
  Sm  Sm37  1  0.580022  0.599879  0.671844  1
  Sm  Sm38  1  0.082823  0.836704  0.650718  1
  Sm  Sm39  1  0.333805  0.319339  0.650750  1
  Sm  Sm40  1  0.848504  0.348006  0.650967  1
  Sm  Sm41  1  0.488057  0.159293  0.710609  1
  Sm  Sm42  1  0.098863  0.349033  0.695322  1
  Sm  Sm43  1  0.302002  0.792558  0.698967  1
  Sm  Sm44  1  0.809130  0.888467  0.691864  1
