# generated using pymatgen
data_ZrSc2(GaNi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.89016257
_cell_length_b   6.89016276
_cell_length_c   3.38280622
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.07477252
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZrSc2(GaNi)3
_chemical_formula_sum   'Zr1 Sc2 Ga3 Ni3'
_cell_volume   138.97573712
_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
  Zr  Zr0  1  0.59286181  0.59286181  0.50000000  1.0
  Sc  Sc1  1  0.40554257  0.00028790  0.50000000  1.0
  Sc  Sc2  1  0.00028790  0.40554257  0.50000000  1.0
  Ga  Ga3  1  0.73863749  0.00335021  0.00000000  1.0
  Ga  Ga4  1  0.00335021  0.73863749  0.00000000  1.0
  Ga  Ga5  1  0.25833068  0.25833068  0.00000000  1.0
  Ni  Ni6  1  0.33717990  0.66694379  0.00000000  1.0
  Ni  Ni7  1  0.66694379  0.33717990  0.00000000  1.0
  Ni  Ni8  1  0.99686566  0.99686566  0.50000000  1.0