# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   13.72811078
_cell_length_b   7.71798659
_cell_length_c   49.58756431
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   75.09859120
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm64
_cell_volume   5077.27750889
_cell_formula_units_Z   64
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  0.579238  0.305242  0.291047  1
  Sm  Sm2  1  0.579238  0.805242  0.291047  1
  Sm  Sm3  1  0.113923  0.185348  0.289631  1
  Sm  Sm4  1  0.113923  0.685348  0.289631  1
  Sm  Sm5  1  0.377702  0.646784  0.326687  1
  Sm  Sm6  1  0.377702  0.146784  0.326687  1
  Sm  Sm7  1  0.858655  0.055502  0.299860  1
  Sm  Sm8  1  0.858655  0.555502  0.299860  1
  Sm  Sm9  1  0.678212  0.472349  0.346842  1
  Sm  Sm10  1  0.678212  0.972349  0.346842  1
  Sm  Sm11  1  0.156162  0.444981  0.349413  1
  Sm  Sm12  1  0.156162  0.944981  0.349413  1
  Sm  Sm13  1  0.492099  0.817299  0.382932  1
  Sm  Sm14  1  0.492099  0.317299  0.382932  1
  Sm  Sm15  1  0.935507  0.255847  0.360039  1
  Sm  Sm16  1  0.935507  0.755847  0.360039  1
  Sm  Sm17  1  0.767817  0.623864  0.403900  1
  Sm  Sm18  1  0.767817  0.123864  0.403900  1
  Sm  Sm19  1  0.274385  0.616063  0.401922  1
  Sm  Sm20  1  0.274385  0.116063  0.401922  1
  Sm  Sm21  1  0.597437  0.979437  0.441624  1
  Sm  Sm22  1  0.597437  0.479437  0.441624  1
  Sm  Sm23  1  0.047419  0.409943  0.415165  1
  Sm  Sm24  1  0.047419  0.909943  0.415165  1
  Sm  Sm25  1  0.879924  0.776509  0.456902  1
  Sm  Sm26  1  0.879924  0.276509  0.456902  1
  Sm  Sm27  1  0.378478  0.779422  0.456183  1
  Sm  Sm28  1  0.378478  0.279422  0.456183  1
  Sm  Sm29  1  0.709496  0.136954  0.497484  1
  Sm  Sm30  1  0.709496  0.636954  0.497484  1
  Sm  Sm31  1  0.154815  0.571672  0.470163  1
  Sm  Sm32  1  0.154815  0.071672  0.470163  1
  Sm  Sm33  1  0.985899  0.930505  0.512053  1
  Sm  Sm34  1  0.985899  0.430505  0.512053  1
  Sm  Sm35  1  0.486859  0.932727  0.511072  1
  Sm  Sm36  1  0.486859  0.432727  0.511072  1
  Sm  Sm37  1  0.816482  0.291557  0.553208  1
  Sm  Sm38  1  0.816482  0.791557  0.553208  1
  Sm  Sm39  1  0.263152  0.732243  0.525028  1
  Sm  Sm40  1  0.263152  0.232243  0.525028  1
  Sm  Sm41  1  0.094433  0.089698  0.567341  1
  Sm  Sm42  1  0.094433  0.589698  0.567341  1
  Sm  Sm43  1  0.593745  0.090827  0.566421  1
  Sm  Sm44  1  0.593745  0.590827  0.566421  1
  Sm  Sm45  1  0.921877  0.444978  0.607973  1
  Sm  Sm46  1  0.921877  0.944978  0.607973  1
  Sm  Sm47  1  0.369910  0.893074  0.579998  1
  Sm  Sm48  1  0.369910  0.393074  0.579998  1
  Sm  Sm49  1  0.206076  0.255416  0.623101  1
  Sm  Sm50  1  0.206076  0.755416  0.623101  1
  Sm  Sm51  1  0.700138  0.243329  0.622506  1
  Sm  Sm52  1  0.700138  0.743329  0.622506  1
  Sm  Sm53  1  0.029366  0.594872  0.661455  1
  Sm  Sm54  1  0.029366  0.094872  0.661455  1
  Sm  Sm55  1  0.477507  0.049115  0.634525  1
  Sm  Sm56  1  0.477507  0.549115  0.634525  1
  Sm  Sm57  1  0.312558  0.442019  0.680121  1
  Sm  Sm58  1  0.312558  0.942019  0.680121  1
  Sm  Sm59  1  0.809050  0.400325  0.679033  1
  Sm  Sm60  1  0.809050  0.900325  0.679033  1
  Sm  Sm61  1  0.119720  0.785586  0.717740  1
  Sm  Sm62  1  0.119720  0.285586  0.717740  1
  Sm  Sm63  1  0.573562  0.206240  0.692244  1
  Sm  Sm64  1  0.573562  0.706240  0.692244  1
