# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84972419
_cell_length_b   15.38055617
_cell_length_c   60.46978644
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.37945983
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm66
_cell_volume   5347.38745759
_cell_formula_units_Z   66
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  0.717048  0.160411  0.163980  1
  Sm  Sm2  1  0.562319  0.472486  0.176447  1
  Sm  Sm3  1  0.401352  0.795363  0.188770  1
  Sm  Sm4  1  0.138577  0.318984  0.170652  1
  Sm  Sm5  1  0.982114  0.633672  0.182631  1
  Sm  Sm6  1  0.823782  0.950613  0.194746  1
  Sm  Sm7  1  0.242208  0.112509  0.201771  1
  Sm  Sm8  1  0.074730  0.448077  0.218455  1
  Sm  Sm9  1  0.915136  0.767509  0.230925  1
  Sm  Sm10  1  0.656169  0.284697  0.211618  1
  Sm  Sm11  1  0.495138  0.607538  0.224532  1
  Sm  Sm12  1  0.334333  0.928997  0.237068  1
  Sm  Sm13  1  0.753180  0.090782  0.242075  1
  Sm  Sm14  1  0.589701  0.417937  0.257348  1
  Sm  Sm15  1  0.427365  0.742931  0.270629  1
  Sm  Sm16  1  0.172027  0.253053  0.249498  1
  Sm  Sm17  1  1.008300  0.580997  0.264223  1
  Sm  Sm18  1  0.846129  0.905358  0.276887  1
  Sm  Sm19  1  0.265565  0.066245  0.283136  1
  Sm  Sm20  1  0.103722  0.389952  0.296786  1
  Sm  Sm21  1  0.940724  0.716175  0.310373  1
  Sm  Sm22  1  0.685116  0.227105  0.289633  1
  Sm  Sm23  1  0.522126  0.553294  0.303742  1
  Sm  Sm24  1  0.359576  0.878445  0.316859  1
  Sm  Sm25  1  0.778800  1.039855  0.323530  1
  Sm  Sm26  1  0.616936  0.363553  0.336778  1
  Sm  Sm27  1  0.454291  0.688974  0.350274  1
  Sm  Sm28  1  0.198071  0.201254  0.330010  1
  Sm  Sm29  1  0.035559  0.526390  0.343609  1
  Sm  Sm30  1  0.873205  0.851129  0.356889  1
  Sm  Sm31  1  0.292191  1.013095  0.363500  1
  Sm  Sm32  1  0.130062  0.337352  0.376756  1
  Sm  Sm33  1  0.967650  0.662253  0.390222  1
  Sm  Sm34  1  0.711192  0.175068  0.370097  1
  Sm  Sm35  1  0.548780  0.499969  0.383563  1
  Sm  Sm36  1  0.386650  0.824225  0.396819  1
  Sm  Sm37  1  0.805637  0.986191  0.403430  1
  Sm  Sm38  1  0.643283  0.310931  0.416710  1
  Sm  Sm39  1  0.480770  0.636067  0.430309  1
  Sm  Sm40  1  0.224551  0.148347  0.410045  1
  Sm  Sm41  1  0.061906  0.473768  0.423540  1
  Sm  Sm42  1  0.900042  0.797465  0.436789  1
  Sm  Sm43  1  0.319266  0.958876  0.443459  1
  Sm  Sm44  1  0.156716  0.284027  0.456577  1
  Sm  Sm45  1  0.993725  0.610216  0.470686  1
  Sm  Sm46  1  0.738118  0.121145  0.449946  1
  Sm  Sm47  1  0.575119  0.447368  0.463533  1
  Sm  Sm48  1  0.413277  0.771075  0.477183  1
  Sm  Sm49  1  0.832712  0.931963  0.483432  1
  Sm  Sm50  1  0.670542  0.256324  0.496096  1
  Sm  Sm51  1  0.506815  0.584268  0.510821  1
  Sm  Sm52  1  0.251477  0.094389  0.489690  1
  Sm  Sm53  1  0.089141  0.419384  0.502971  1
  Sm  Sm54  1  0.925662  0.746539  0.518244  1
  Sm  Sm55  1  0.344508  0.908323  0.523251  1
  Sm  Sm56  1  0.183703  0.229783  0.535787  1
  Sm  Sm57  1  0.022673  0.552623  0.548701  1
  Sm  Sm58  1  0.763706  0.069811  0.529394  1
  Sm  Sm59  1  0.604111  0.389243  0.541863  1
  Sm  Sm60  1  0.436634  0.724812  0.558548  1
  Sm  Sm61  1  0.855060  0.886708  0.565573  1
  Sm  Sm62  1  0.696727  0.203649  0.577688  1
  Sm  Sm63  1  0.540265  0.518337  0.589667  1
  Sm  Sm64  1  0.277489  1.041957  0.571549  1
  Sm  Sm65  1  0.116523  0.364835  0.583872  1
  Sm  Sm66  1  0.961794  0.676909  0.596339  1
