# generated using pymatgen
data_ScNiSn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.59726312
_cell_length_b   7.13621337
_cell_length_c   7.13634627
_cell_angle_alpha   119.99938701
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNiSn
_chemical_formula_sum   'Sc3 Ni3 Sn3'
_cell_volume   158.65335520
_cell_formula_units_Z   3
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  -0.00000000  0.39870538  0.00000000  1.0
  Sc  Sc1  1  -0.00000000  0.60127149  0.60124962  1.0
  Sc  Sc2  1  -0.00000000  1.00002087  0.39875038  1.0
  Ni  Ni3  1  -0.00000000  0.99929551  1.00000000  1.0
  Ni  Ni4  1  0.50000000  0.33340008  0.66620246  1.0
  Ni  Ni5  1  0.50000000  0.66719862  0.33379754  1.0
  Sn  Sn6  1  0.50000000  0.73212007  1.00000000  1.0
  Sn  Sn7  1  0.50000000  0.26782341  0.26775884  1.0
  Sn  Sn8  1  0.50000000  0.00006557  0.73224116  1.0