# generated using pymatgen
data_ScGa2(Ni10B3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.38913883
_cell_length_b   7.38913920
_cell_length_c   7.38913889
_cell_angle_alpha   60.00000572
_cell_angle_beta   60.00000409
_cell_angle_gamma   60.00000185
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScGa2(Ni10B3)2
_chemical_formula_sum   'Sc1 Ga2 Ni20 B6'
_cell_volume   285.27685953
_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  0.25000000  0.25000000  0.25000000  1.0
  Ga  Ga1  1  0.00000000  0.00000000  0.00000000  1.0
  Ga  Ga2  1  0.75000000  0.75000000  0.75000000  1.0
  Ni  Ni3  1  0.33807985  0.00004230  0.00004230  1.0
  Ni  Ni4  1  0.00004230  0.33807985  0.66183555  1.0
  Ni  Ni5  1  0.66183555  0.00004230  0.00004230  1.0
  Ni  Ni6  1  0.00004230  0.66183555  0.33807985  1.0
  Ni  Ni7  1  0.00004230  0.33807985  0.00004230  1.0
  Ni  Ni8  1  0.00004230  0.00004230  0.33807985  1.0
  Ni  Ni9  1  0.33807985  0.00004230  0.66183555  1.0
  Ni  Ni10  1  0.33807985  0.66183555  0.00004230  1.0
  Ni  Ni11  1  0.66183555  0.00004230  0.33807985  1.0
  Ni  Ni12  1  0.00004230  0.00004230  0.66183555  1.0
  Ni  Ni13  1  0.00004230  0.66183555  0.00004230  1.0
  Ni  Ni14  1  0.66183555  0.33807985  0.00004230  1.0
  Ni  Ni15  1  0.38736653  0.38736653  0.38736653  1.0
  Ni  Ni16  1  0.38736653  0.38736653  0.83789941  1.0
  Ni  Ni17  1  0.83789941  0.38736653  0.38736653  1.0
  Ni  Ni18  1  0.38736653  0.83789941  0.38736653  1.0
  Ni  Ni19  1  0.61973125  0.61973125  0.61973125  1.0
  Ni  Ni20  1  0.61973125  0.61973125  0.14080726  1.0
  Ni  Ni21  1  0.61973125  0.14080726  0.61973125  1.0
  Ni  Ni22  1  0.14080726  0.61973125  0.61973125  1.0
  B  B23  1  0.72559688  0.72559688  0.27440312  1.0
  B  B24  1  0.27440312  0.27440312  0.72559688  1.0
  B  B25  1  0.27440312  0.72559688  0.72559688  1.0
  B  B26  1  0.72559688  0.27440312  0.72559688  1.0
  B  B27  1  0.72559688  0.27440312  0.27440312  1.0
  B  B28  1  0.27440312  0.72559688  0.27440312  1.0