# generated using pymatgen
data_Nb6Al(VNi)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.58645100
_cell_length_b   9.58645041
_cell_length_c   9.58644952
_cell_angle_alpha   29.96949184
_cell_angle_beta   29.96949710
_cell_angle_gamma   29.96948516
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb6Al(VNi)3
_chemical_formula_sum   'Nb6 Al1 V3 Ni3'
_cell_volume   194.72383544
_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
  Nb  Nb0  1  0.83461981  0.83461981  0.83461981  1.0
  Nb  Nb1  1  0.16803165  0.16803165  0.16803165  1.0
  Nb  Nb2  1  0.65104356  0.65104356  0.65104356  1.0
  Nb  Nb3  1  0.34775955  0.34775955  0.34775955  1.0
  Nb  Nb4  1  0.55438642  0.55438642  0.55438642  1.0
  Nb  Nb5  1  0.45849468  0.45849468  0.45849468  1.0
  Al  Al6  1  0.99347242  0.99347242  0.99347242  1.0
  V  V7  1  0.41027400  0.90744664  0.90744664  1.0
  V  V8  1  0.90744664  0.90744664  0.41027400  1.0
  V  V9  1  0.90744664  0.41027400  0.90744664  1.0
  Ni  Ni10  1  0.58319218  0.09191623  0.09191623  1.0
  Ni  Ni11  1  0.09191623  0.09191623  0.58319218  1.0
  Ni  Ni12  1  0.09191623  0.58319218  0.09191623  1.0