# generated using pymatgen
data_Nb4N5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.31147514
_cell_length_b   5.35665139
_cell_length_c   5.35665241
_cell_angle_alpha   80.67937556
_cell_angle_beta   66.26912165
_cell_angle_gamma   66.26911994
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nb4N5
_chemical_formula_sum   'Nb4 N5'
_cell_volume   103.67595399
_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  0.60510377  0.17801938  0.61177207  1.0
  Nb  Nb1  1  0.21687684  0.38822793  0.17801938  1.0
  Nb  Nb2  1  0.78312316  0.61177207  0.82198062  1.0
  Nb  Nb3  1  0.39489623  0.82198062  0.38822793  1.0
  N  N4  1  0.50000000  0.00000000  -0.00000000  1.0
  N  N5  1  0.90740444  0.78452876  0.40066235  1.0
  N  N6  1  0.30806679  0.59933765  0.78452876  1.0
  N  N7  1  0.69193321  0.40066235  0.21547124  1.0
  N  N8  1  0.09259556  0.21547124  0.59933765  1.0