# generated using pymatgen
data_ScGa2Ni
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05192519
_cell_length_b   9.58423968
_cell_length_c   6.47056229
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScGa2Ni
_chemical_formula_sum   'Sc4 Ga8 Ni4'
_cell_volume   251.28184187
_cell_formula_units_Z   4
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  0.07543900  0.25000000  1
  Sc  Sc1  1  0.50000000  0.42456100  0.75000000  1
  Sc  Sc2  1  0.50000000  0.57543900  0.25000000  1
  Sc  Sc3  1  0.00000000  0.92456100  0.75000000  1
  Ga  Ga4  1  0.00000000  0.36285800  0.45061300  1
  Ga  Ga5  1  0.50000000  0.13714200  0.54938700  1
  Ga  Ga6  1  0.50000000  0.13714200  0.95061300  1
  Ga  Ga7  1  0.00000000  0.36285800  0.04938700  1
  Ga  Ga8  1  0.50000000  0.86285800  0.45061300  1
  Ga  Ga9  1  0.00000000  0.63714200  0.54938700  1
  Ga  Ga10  1  0.00000000  0.63714200  0.95061300  1
  Ga  Ga11  1  0.50000000  0.86285800  0.04938700  1
  Ni  Ni12  1  0.50000000  0.29418800  0.25000000  1
  Ni  Ni13  1  0.00000000  0.20581200  0.75000000  1
  Ni  Ni14  1  0.00000000  0.79418800  0.25000000  1
  Ni  Ni15  1  0.50000000  0.70581200  0.75000000  1
