# generated using pymatgen
data_SmAl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.28141042
_cell_length_b   10.98936996
_cell_length_c   54.03454085
_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   'Sm18 Al18'
_cell_volume   1948.51975367
_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  1.036538  0.277028  0.282477  1
  Sm  Sm2  1  1.036538  1.005854  0.248585  1
  Sm  Sm3  1  1.036538  0.699102  0.233960  1
  Sm  Sm4  1  1.036538  0.150134  0.345012  1
  Sm  Sm5  1  1.036538  0.850934  0.328432  1
  Sm  Sm6  1  1.036538  0.579441  0.297267  1
  Sm  Sm7  1  1.036538  0.991067  0.424212  1
  Sm  Sm8  1  1.036538  0.720494  0.393351  1
  Sm  Sm9  1  1.036538  0.421501  0.376587  1
  Sm  Sm10  1  1.036538  0.858419  0.488917  1
  Sm  Sm11  1  1.036538  0.559426  0.472152  1
  Sm  Sm12  1  1.036538  0.288853  0.441291  1
  Sm  Sm13  1  1.036538  0.700479  0.568236  1
  Sm  Sm14  1  1.036538  0.428986  0.537071  1
  Sm  Sm15  1  1.036538  0.129786  0.520491  1
  Sm  Sm16  1  1.036538  0.580818  0.631543  1
  Sm  Sm17  1  1.036538  0.274066  0.616918  1
  Sm  Sm18  1  1.036538  1.002892  0.583026  1
  Al  Al19  1  0.536538  0.243808  0.232521  1
  Al  Al20  1  0.536538  0.808585  0.279012  1
  Al  Al21  1  0.536538  0.472716  0.251758  1
  Al  Al22  1  0.536538  0.047975  0.298488  1
  Al  Al23  1  0.536538  0.623426  0.347131  1
  Al  Al24  1  0.536538  0.381943  0.327318  1
  Al  Al25  1  0.536538  0.949246  0.374440  1
  Al  Al26  1  0.536538  0.518134  0.422578  1
  Al  Al27  1  0.536538  0.192520  0.394826  1
  Al  Al28  1  0.536538  0.761786  0.442925  1
  Al  Al29  1  0.536538  0.330674  0.491063  1
  Al  Al30  1  0.536538  0.087400  0.470677  1
  Al  Al31  1  0.536538  0.656494  0.518373  1
  Al  Al32  1  0.536538  0.231945  0.567015  1
  Al  Al33  1  0.536538  0.897977  0.538185  1
  Al  Al34  1  0.536538  0.471335  0.586491  1
  Al  Al35  1  0.536538  0.036112  0.632982  1
  Al  Al36  1  0.536538  0.807204  0.613745  1
