# generated using pymatgen
data_NbAlCr4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.90073301
_cell_length_b   4.90073301
_cell_length_c   7.80198800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998666
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NbAlCr4
_chemical_formula_sum   'Nb2 Al2 Cr8'
_cell_volume   162.27740503
_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  0.66666700  0.33333300  0.93763600  1.0
  Nb  Nb1  1  0.33333300  0.66666700  0.06236400  1.0
  Al  Al2  1  0.33333300  0.66666700  0.43572200  1.0
  Al  Al3  1  0.66666700  0.33333300  0.56427800  1.0
  Cr  Cr4  1  0.00000000  0.00000000  0.50000000  1.0
  Cr  Cr5  1  0.00000000  0.00000000  0.00000000  1.0
  Cr  Cr6  1  0.82902200  0.17097800  0.25556700  1.0
  Cr  Cr7  1  0.82902200  0.65804500  0.25556700  1.0
  Cr  Cr8  1  0.34195500  0.17097800  0.25556700  1.0
  Cr  Cr9  1  0.17097800  0.82902200  0.74443300  1.0
  Cr  Cr10  1  0.17097800  0.34195500  0.74443300  1.0
  Cr  Cr11  1  0.65804500  0.82902200  0.74443300  1.0