# generated using pymatgen
data_Sc12Ni5Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.73893552
_cell_length_b   7.73893518
_cell_length_c   7.73893332
_cell_angle_alpha   106.68530847
_cell_angle_beta   110.47887590
_cell_angle_gamma   111.28597024
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc12Ni5Sn
_chemical_formula_sum   'Sc12 Ni5 Sn1'
_cell_volume   356.14997828
_cell_formula_units_Z   1
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
  Sc  Sc0  1  0.46868880  0.28615958  0.18252922  1.0
  Sc  Sc1  1  0.10363135  0.28615958  0.81747078  1.0
  Sc  Sc2  1  0.89636865  0.71384042  0.18252922  1.0
  Sc  Sc3  1  0.53131120  0.71384042  0.81747078  1.0
  Sc  Sc4  1  0.30142836  0.62350671  0.32207935  1.0
  Sc  Sc5  1  0.30142836  0.97935001  0.67792065  1.0
  Sc  Sc6  1  0.69857164  0.37649329  0.67792065  1.0
  Sc  Sc7  1  0.69857164  0.02064999  0.32207935  1.0
  Sc  Sc8  1  0.19685136  0.21813850  0.41498886  1.0
  Sc  Sc9  1  0.80314864  0.78186150  0.58501114  1.0
  Sc  Sc10  1  0.19685136  0.78186150  0.97871186  1.0
  Sc  Sc11  1  0.80314864  0.21813850  0.02128814  1.0
  Ni  Ni12  1  0.50000000  0.62715610  0.12715610  1.0
  Ni  Ni13  1  0.50000000  0.37284390  0.87284390  1.0
  Ni  Ni14  1  0.35781636  1.00000000  0.35781636  1.0
  Ni  Ni15  1  0.64218364  0.00000000  0.64218364  1.0
  Ni  Ni16  1  0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn17  1  0.00000000  0.50000000  0.50000000  1.0