# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.84107368
_cell_length_b   3.83703650
_cell_length_c   46.28921340
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm28
_cell_volume   2103.13337282
_cell_formula_units_Z   28
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  0.002899  0.526569  0.319437  1
  Sm  Sm2  1  0.501823  0.526569  0.319437  1
  Sm  Sm3  1  0.752361  0.974701  0.335332  1
  Sm  Sm4  1  0.252361  0.096261  0.299226  1
  Sm  Sm5  1  0.004631  0.118736  0.385987  1
  Sm  Sm6  1  0.500091  0.118736  0.385987  1
  Sm  Sm7  1  0.752361  0.535836  0.401654  1
  Sm  Sm8  1  0.252361  0.716301  0.367174  1
  Sm  Sm9  1  1.002031  0.717297  0.452208  1
  Sm  Sm10  1  0.502691  0.717297  0.452208  1
  Sm  Sm11  1  0.752361  0.129638  0.469018  1
  Sm  Sm12  1  0.252361  0.309978  0.434610  1
  Sm  Sm13  1  1.002361  0.312819  0.518780  1
  Sm  Sm14  1  0.502361  0.312819  0.518780  1
  Sm  Sm15  1  0.752361  0.723670  0.535953  1
  Sm  Sm16  1  0.252361  0.901969  0.501608  1
  Sm  Sm17  1  0.002691  0.908342  0.585353  1
  Sm  Sm18  1  0.502031  0.908342  0.585353  1
  Sm  Sm19  1  0.752361  0.315660  0.602950  1
  Sm  Sm20  1  0.252361  0.496001  0.568542  1
  Sm  Sm21  1  1.000091  0.506903  0.651574  1
  Sm  Sm22  1  0.504631  0.506903  0.651574  1
  Sm  Sm23  1  0.752361  0.909338  0.670387  1
  Sm  Sm24  1  0.252361  0.089803  0.635907  1
  Sm  Sm25  1  1.001823  0.099069  0.718123  1
  Sm  Sm26  1  0.502899  0.099069  0.718123  1
  Sm  Sm27  1  0.752361  0.529378  0.738335  1
  Sm  Sm28  1  0.252361  0.650937  0.702229  1
