# generated using pymatgen
data_NdSc2Ni9
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.35075937
_cell_length_b   8.35075878
_cell_length_c   8.35075814
_cell_angle_alpha   33.95566503
_cell_angle_beta   33.95566919
_cell_angle_gamma   33.95567575
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdSc2Ni9
_chemical_formula_sum   'Nd1 Sc2 Ni9'
_cell_volume   161.93209514
_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
  Nd  Nd0  1  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc1  1  0.85816496  0.85816496  0.85816496  1.0
  Sc  Sc2  1  0.14183504  0.14183504  0.14183504  1.0
  Ni  Ni3  1  0.41313022  0.91838972  0.41313022  1.0
  Ni  Ni4  1  0.41313022  0.41313022  0.91838972  1.0
  Ni  Ni5  1  0.91838972  0.41313022  0.41313022  1.0
  Ni  Ni6  1  0.58686978  0.08161028  0.58686978  1.0
  Ni  Ni7  1  0.58686978  0.58686978  0.08161028  1.0
  Ni  Ni8  1  0.08161028  0.58686978  0.58686978  1.0
  Ni  Ni9  1  0.66648466  0.66648466  0.66648466  1.0
  Ni  Ni10  1  0.33351534  0.33351534  0.33351534  1.0
  Ni  Ni11  1  0.50000000  0.50000000  0.50000000  1.0