# generated using pymatgen
data_Sc2Ni2Sn
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.39105258
_cell_length_b   7.06097638
_cell_length_c   7.06097638
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2Ni2Sn
_chemical_formula_sum   'Sc4 Ni4 Sn2'
_cell_volume   169.06902231
_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  0.50000000  0.17087965  0.67087965  1.0
  Sc  Sc1  1  0.50000000  0.32912035  0.17087965  1.0
  Sc  Sc2  1  0.50000000  0.67087965  0.82912035  1.0
  Sc  Sc3  1  0.50000000  0.82912035  0.32912035  1.0
  Ni  Ni4  1  -0.00000000  0.37748049  0.87748049  1.0
  Ni  Ni5  1  0.00000000  0.12251951  0.37748049  1.0
  Ni  Ni6  1  -0.00000000  0.87748049  0.62251951  1.0
  Ni  Ni7  1  0.00000000  0.62251951  0.12251951  1.0
  Sn  Sn8  1  0.00000000  0.00000000  0.00000000  1.0
  Sn  Sn9  1  0.00000000  0.50000000  0.50000000  1.0