# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.37483743
_cell_length_b   6.86927629
_cell_length_c   51.82248524
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   95.93341426
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm42
_cell_volume   3319.40364502
_cell_formula_units_Z   42
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  0.483516  0.471558  0.265062  1
  Sm  Sm2  1  0.832279  0.350796  0.286143  1
  Sm  Sm3  1  0.178205  0.225658  0.303919  1
  Sm  Sm4  1  0.550980  0.972218  0.269958  1
  Sm  Sm5  1  0.902482  0.838680  0.287031  1
  Sm  Sm6  1  0.248947  0.718433  0.309877  1
  Sm  Sm7  1  0.509822  0.159279  0.329610  1
  Sm  Sm8  1  0.847429  0.046126  0.347212  1
  Sm  Sm9  1  0.185902  0.940899  0.367903  1
  Sm  Sm10  1  0.595467  0.638092  0.330458  1
  Sm  Sm11  1  0.933109  0.527855  0.350873  1
  Sm  Sm12  1  0.270970  0.423218  0.371362  1
  Sm  Sm13  1  0.525279  0.835614  0.388301  1
  Sm  Sm14  1  0.864606  0.733706  0.408873  1
  Sm  Sm15  1  0.204593  0.627604  0.429115  1
  Sm  Sm16  1  0.611927  0.320969  0.392824  1
  Sm  Sm17  1  0.952692  0.215026  0.412404  1
  Sm  Sm18  1  0.291114  0.109365  0.433127  1
  Sm  Sm19  1  0.542830  0.523763  0.450000  1
  Sm  Sm20  1  0.882472  0.418451  0.470015  1
  Sm  Sm21  1  0.221385  0.314009  0.490671  1
  Sm  Sm22  1  0.631179  0.004487  0.453427  1
  Sm  Sm23  1  0.970092  0.900044  0.474083  1
  Sm  Sm24  1  0.309734  0.794733  0.494099  1
  Sm  Sm25  1  0.561450  0.209131  0.510971  1
  Sm  Sm26  1  0.899872  0.103470  0.531695  1
  Sm  Sm27  1  0.240637  -0.002474  0.551274  1
  Sm  Sm28  1  0.647971  0.690892  0.514984  1
  Sm  Sm29  1  0.987958  0.584790  0.535225  1
  Sm  Sm30  1  0.327285  0.482881  0.555798  1
  Sm  Sm31  1  0.581594  0.895277  0.572736  1
  Sm  Sm32  1  0.919455  0.790640  0.593226  1
  Sm  Sm33  1  0.257097  0.680403  0.613641  1
  Sm  Sm34  1  0.666662  0.377596  0.576196  1
  Sm  Sm35  1  1.005135  0.272369  0.596887  1
  Sm  Sm36  1  0.342742  0.159217  0.614489  1
  Sm  Sm37  1  0.603617  0.600063  0.634222  1
  Sm  Sm38  1  0.950082  0.479816  0.657068  1
  Sm  Sm39  1  0.301584  0.346278  0.674140  1
  Sm  Sm40  1  0.674359  0.092837  0.640180  1
  Sm  Sm41  1  1.020285  0.967699  0.657956  1
  Sm  Sm42  1  0.369048  0.846938  0.679036  1
