# generated using pymatgen
data_SmAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.94199146
_cell_length_b   7.85779435
_cell_length_c   47.56186861
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   108.43494882
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmAl
_chemical_formula_sum   'Sm18 Al18'
_cell_volume   1752.19651641
_cell_formula_units_Z   18
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  0.856612  0.335691  0.272614  1
  Sm  Sm2  1  0.124280  0.871125  0.283912  1
  Sm  Sm3  1  0.325614  0.273168  0.328911  1
  Sm  Sm4  1  0.544938  0.710973  0.354440  1
  Sm  Sm5  1  0.775022  0.171706  0.374250  1
  Sm  Sm6  1  0.985300  0.591520  0.400111  1
  Sm  Sm7  1  0.206606  0.033535  0.421405  1
  Sm  Sm8  1  0.434058  0.486849  0.452762  1
  Sm  Sm9  1  0.657825  0.933462  0.477289  1
  Sm  Sm10  1  0.878963  0.375377  0.500172  1
  Sm  Sm11  1  0.098853  0.814552  0.524989  1
  Sm  Sm12  1  0.322553  0.261533  0.548505  1
  Sm  Sm13  1  0.546944  0.709452  0.577097  1
  Sm  Sm14  1  0.769778  0.154665  0.600906  1
  Sm  Sm15  1  0.988402  0.591296  0.623765  1
  Sm  Sm16  1  0.209339  0.032125  0.647897  1
  Sm  Sm17  1  0.435792  0.483869  0.673805  1
  Sm  Sm18  1  0.662205  0.932121  0.705965  1
  Al  Al19  1  0.493369  0.609663  0.291974  1
  Al  Al20  1  0.699429  0.021254  0.314785  1
  Al  Al21  1  0.958508  0.538747  0.329458  1
  Al  Al22  1  0.149678  0.919905  0.355683  1
  Al  Al23  1  0.378508  0.378515  0.391658  1
  Al  Al24  1  0.598919  0.818693  0.415780  1
  Al  Al25  1  0.818778  0.257099  0.438033  1
  Al  Al26  1  0.048651  0.715555  0.462004  1
  Al  Al27  1  0.264550  0.146535  0.485689  1
  Al  Al28  1  0.490970  0.599156  0.514677  1
  Al  Al29  1  0.710836  0.038355  0.539261  1
  Al  Al30  1  0.933662  0.483288  0.562154  1
  Al  Al31  1  0.159009  0.933363  0.585998  1
  Al  Al32  1  0.377467  0.369747  0.611152  1
  Al  Al33  1  0.603106  0.820393  0.639785  1
  Al  Al34  1  0.820330  0.253538  0.665087  1
  Al  Al35  1  0.047740  0.705401  0.686762  1
  Al  Al36  1  0.279115  0.164085  0.709454  1
