# generated using pymatgen
data_SmAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.75291797
_cell_length_b   5.87084993
_cell_length_c   58.44756790
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmAl
_chemical_formula_sum   'Sm16 Al16'
_cell_volume   1974.03843754
_cell_formula_units_Z   16
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  0.750401  0.676292  0.401069  1
  Sm  Sm2  1  0.750401  0.891471  0.464766  1
  Sm  Sm3  1  0.750401  0.404390  0.303547  1
  Sm  Sm4  1  0.750401  0.128134  0.364599  1
  Sm  Sm5  1  0.250401  0.892102  0.431316  1
  Sm  Sm6  1  0.250401  0.674932  0.495529  1
  Sm  Sm7  1  0.250401  0.076571  0.327849  1
  Sm  Sm8  1  0.250401  0.338172  0.395273  1
  Sm  Sm9  1  0.750401  0.675409  0.601169  1
  Sm  Sm10  1  0.750401  0.937010  0.668594  1
  Sm  Sm11  1  0.750401  0.338649  0.500914  1
  Sm  Sm12  1  0.750401  0.121479  0.565127  1
  Sm  Sm13  1  0.250401  0.885447  0.631844  1
  Sm  Sm14  1  0.250401  0.609191  0.692896  1
  Sm  Sm15  1  0.250401  0.122110  0.531677  1
  Sm  Sm16  1  0.250401  0.337289  0.595373  1
  Al  Al17  1  0.500093  0.419137  0.448181  1
  Al  Al18  1  0.500092  0.590342  0.348823  1
  Al  Al19  1  0.750401  0.162992  0.417772  1
  Al  Al20  1  0.750401  0.888683  0.318441  1
  Al  Al21  1  0.000708  0.419137  0.448181  1
  Al  Al22  1  0.000709  0.590342  0.348823  1
  Al  Al23  1  0.250401  0.161672  0.478559  1
  Al  Al24  1  0.250401  0.854481  0.377807  1
  Al  Al25  1  0.500709  0.423239  0.647620  1
  Al  Al26  1  0.500708  0.594444  0.548262  1
  Al  Al27  1  0.750401  0.159100  0.618636  1
  Al  Al28  1  0.750401  0.851909  0.517884  1
  Al  Al29  1  1.000092  0.423239  0.647620  1
  Al  Al30  1  1.000093  0.594444  0.548262  1
  Al  Al31  1  0.250401  0.124898  0.678002  1
  Al  Al32  1  0.250401  0.850589  0.578671  1
