# generated using pymatgen
data_ScGaNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.08154400
_cell_length_b   5.09032968
_cell_length_c   5.41844372
_cell_angle_alpha   92.26707551
_cell_angle_beta   112.24624618
_cell_angle_gamma   66.24871604
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScGaNi
_chemical_formula_sum   'Sc2 Ga2 Ni2'
_cell_volume   94.51999617
_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  0.74465210  0.69855844  0.18936735  1.0
  Sc  Sc1  1  0.25535373  0.30142990  0.81063280  1.0
  Ga  Ga2  1  0.57212029  0.25317610  0.39736844  1.0
  Ga  Ga3  1  0.42786854  0.74682982  0.60261473  1.0
  Ni  Ni4  1  0.03752907  0.11943945  0.19474806  1.0
  Ni  Ni5  1  0.96247727  0.88056629  0.80526763  1.0