# generated using pymatgen
data_ScGaNi2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.23545436
_cell_length_b   4.23545446
_cell_length_c   4.23545426
_cell_angle_alpha   60.00000159
_cell_angle_beta   60.00000077
_cell_angle_gamma   59.99999223
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScGaNi2
_chemical_formula_sum   'Sc1 Ga1 Ni2'
_cell_volume   53.72606133
_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  0.50000000  0.50000000  0.50000000  1.0
  Ga  Ga1  1  -0.00000000  0.00000000  -0.00000000  1.0
  Ni  Ni2  1  0.25000000  0.25000000  0.25000000  1.0
  Ni  Ni3  1  0.75000000  0.75000000  0.75000000  1.0