# generated using pymatgen
data_Zr2Nb2Al3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.29456288
_cell_length_b   5.29455739
_cell_length_c   5.25555986
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99896292
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr2Nb2Al3
_chemical_formula_sum   'Zr2 Nb2 Al3'
_cell_volume   127.58920392
_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  0.66667058  0.33333178  0.50000000  1.0
  Zr  Zr1  1  0.99998934  0.00001278  0.50000000  1.0
  Nb  Nb2  1  0.33333274  0.66666837  0.73482833  1.0
  Nb  Nb3  1  0.33333274  0.66666837  0.26517367  1.0
  Al  Al4  1  0.83333766  0.66667449  0.00000000  1.0
  Al  Al5  1  0.83331502  0.16666262  0.00000000  1.0
  Al  Al6  1  0.33332693  0.16668861  0.00000000  1.0