# generated using pymatgen
data_ScNbC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62749566
_cell_length_b   5.62749553
_cell_length_c   5.62749675
_cell_angle_alpha   33.21610033
_cell_angle_beta   33.21609882
_cell_angle_gamma   33.21609695
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNbC2
_chemical_formula_sum   'Sc1 Nb1 C2'
_cell_volume   47.60881080
_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  0.00000000  0.00000000  0.00000000  1.0
  Nb  Nb1  1  0.50000000  0.50000000  0.50000000  1.0
  C  C2  1  0.24554209  0.24554209  0.24554209  1.0
  C  C3  1  0.75445791  0.75445791  0.75445791  1.0