# generated using pymatgen
data_Nb2GaNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.92160286
_cell_length_b   4.92160286
_cell_length_c   7.77771255
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb2GaNi3
_chemical_formula_sum   'Nb4 Ga2 Ni6'
_cell_volume   163.15322110
_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
  Nb  Nb0  1  0.33333300  0.66666700  0.44033400  1
  Nb  Nb1  1  0.66666700  0.33333300  0.55966600  1
  Nb  Nb2  1  0.66666700  0.33333300  0.94033400  1
  Nb  Nb3  1  0.33333300  0.66666700  0.05966600  1
  Ga  Ga4  1  0.00000000  0.00000000  0.50000000  1
  Ga  Ga5  1  0.00000000  0.00000000  0.00000000  1
  Ni  Ni6  1  0.82808400  0.17191600  0.25000000  1
  Ni  Ni7  1  0.82808400  0.65616900  0.25000000  1
  Ni  Ni8  1  0.34383100  0.17191600  0.25000000  1
  Ni  Ni9  1  0.17191600  0.82808400  0.75000000  1
  Ni  Ni10  1  0.17191600  0.34383100  0.75000000  1
  Ni  Ni11  1  0.65616900  0.82808400  0.75000000  1
