# generated using pymatgen
data_ScPaNi2Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.25801027
_cell_length_b   7.22332570
_cell_length_c   3.46872691
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScPaNi2Sn
_chemical_formula_sum   'Sc2 Pa2 Ni4 Sn2'
_cell_volume   181.85484866
_cell_formula_units_Z   2
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  0.82585490  0.67305364  0.50000000  1.0
  Sc  Sc1  1  0.32585490  0.82694636  0.50000000  1.0
  Pa  Pa2  1  0.67109477  0.16928996  0.50000000  1.0
  Pa  Pa3  1  0.17109477  0.33071004  0.50000000  1.0
  Ni  Ni4  1  0.87147775  0.36781237  0.00000000  1.0
  Ni  Ni5  1  0.37147775  0.13218763  0.00000000  1.0
  Ni  Ni6  1  0.62676599  0.89012130  0.00000000  1.0
  Ni  Ni7  1  0.12676599  0.60987870  0.00000000  1.0
  Sn  Sn8  1  0.00480659  0.97502821  0.00000000  1.0
  Sn  Sn9  1  0.50480659  0.52497179  0.00000000  1.0