# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.19161390
_cell_length_b   6.20867889
_cell_length_c   46.81425483
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   78.61485466
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm
_chemical_formula_sum   Sm42
_cell_volume   3473.82098878
_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  0.861876  0.099763  0.321765  1
  Sm  Sm2  1  0.210202  0.262566  0.292657  1
  Sm  Sm3  1  0.532671  0.173520  0.310037  1
  Sm  Sm4  1  0.691696  0.644652  0.314564  1
  Sm  Sm5  1  0.006491  0.528219  0.338033  1
  Sm  Sm6  1  0.369075  0.707910  0.305668  1
  Sm  Sm7  1  0.786905  0.741320  0.385008  1
  Sm  Sm8  1  0.152812  0.919604  0.354592  1
  Sm  Sm9  1  0.471225  0.804692  0.373354  1
  Sm  Sm10  1  0.626975  0.282417  0.376514  1
  Sm  Sm11  1  0.939611  0.158730  0.398953  1
  Sm  Sm12  1  0.307962  0.342359  0.366771  1
  Sm  Sm13  1  0.718123  0.385398  0.446754  1
  Sm  Sm14  1  0.084930  0.561950  0.416209  1
  Sm  Sm15  1  0.401133  0.449187  0.435666  1
  Sm  Sm16  1  0.557777  0.928236  0.439589  1
  Sm  Sm17  1  0.871849  0.805299  0.461057  1
  Sm  Sm18  1  0.240354  0.987066  0.429063  1
  Sm  Sm19  1  0.649511  0.028898  0.509059  1
  Sm  Sm20  1  0.017169  0.209384  0.477645  1
  Sm  Sm21  1  0.332012  0.090836  0.498283  1
  Sm  Sm22  1  0.489507  0.569134  0.502054  1
  Sm  Sm23  1  0.804350  0.450586  0.522692  1
  Sm  Sm24  1  0.172008  0.631072  0.491278  1
  Sm  Sm25  1  0.581165  0.672904  0.571275  1
  Sm  Sm26  1  0.949669  0.854671  0.539280  1
  Sm  Sm27  1  0.263742  0.731734  0.560748  1
  Sm  Sm28  1  0.420386  0.210783  0.564672  1
  Sm  Sm29  1  0.736589  0.098020  0.584128  1
  Sm  Sm30  1  0.103396  0.274572  0.553584  1
  Sm  Sm31  1  0.513557  0.317611  0.633567  1
  Sm  Sm32  1  0.881908  0.501240  0.601385  1
  Sm  Sm33  1  0.194544  0.377553  0.623823  1
  Sm  Sm34  1  0.350294  0.855278  0.626984  1
  Sm  Sm35  1  0.668706  0.740366  0.645746  1
  Sm  Sm36  1  0.034614  0.918650  0.615329  1
  Sm  Sm37  1  0.452444  0.952060  0.694669  1
  Sm  Sm38  1  0.815027  0.131751  0.662305  1
  Sm  Sm39  1  0.129822  0.015318  0.685774  1
  Sm  Sm40  1  0.288848  0.486450  0.690301  1
  Sm  Sm41  1  0.611317  0.397404  0.707680  1
  Sm  Sm42  1  0.959643  0.560207  0.678573  1
