# generated using pymatgen
data_Sm
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   11.74219343
_cell_length_b   3.83077034
_cell_length_c   49.62024158
_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   2232.00015901
_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  0.964838  0.943085  0.294596  1
  Sm  Sm2  1  0.548345  0.943085  0.294596  1
  Sm  Sm3  1  0.756591  0.661921  0.341382  1
  Sm  Sm4  1  0.256591  0.493770  0.309218  1
  Sm  Sm5  1  0.012030  0.292779  0.358287  1
  Sm  Sm6  1  0.501153  0.292779  0.358287  1
  Sm  Sm7  1  0.756591  0.105955  0.403872  1
  Sm  Sm8  1  0.256591  0.881962  0.373655  1
  Sm  Sm9  1  1.006239  0.694437  0.420021  1
  Sm  Sm10  1  0.506944  0.694437  0.420021  1
  Sm  Sm11  1  0.756591  0.510921  0.466347  1
  Sm  Sm12  1  0.256591  0.285541  0.435952  1
  Sm  Sm13  1  0.007158  0.099394  0.482462  1
  Sm  Sm14  1  0.506025  0.099394  0.482462  1
  Sm  Sm15  1  0.756591  0.917722  0.528434  1
  Sm  Sm16  1  0.256591  0.688783  0.498847  1
  Sm  Sm17  1  0.007313  0.504985  0.545045  1
  Sm  Sm18  1  0.505870  0.504985  0.545045  1
  Sm  Sm19  1  0.756591  0.322509  0.590357  1
  Sm  Sm20  1  0.256591  0.093646  0.561467  1
  Sm  Sm21  1  0.008651  0.914081  0.608079  1
  Sm  Sm22  1  0.504532  0.914081  0.608079  1
  Sm  Sm23  1  0.756591  0.734171  0.650621  1
  Sm  Sm24  1  0.256591  0.487711  0.623851  1
  Sm  Sm25  1  0.999481  0.344018  0.671766  1
  Sm  Sm26  1  0.513701  0.344018  0.671766  1
  Sm  Sm27  1  0.756591  0.079521  0.715502  1
  Sm  Sm28  1  0.256591  0.888610  0.686587  1
