# generated using pymatgen
data_AlFeN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34624580
_cell_length_b   6.23799999
_cell_length_c   4.95060604
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlFeN2
_chemical_formula_sum   'Al4 Fe4 N8'
_cell_volume   165.10212353
_cell_formula_units_Z   4
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
  Al  Al0  1  0.00293600  0.58845000  0.37659400  1
  Al  Al1  1  0.50293600  0.41155000  0.62340600  1
  Al  Al2  1  0.50293600  0.91155000  0.87659400  1
  Al  Al3  1  0.00293600  0.08845000  0.12340600  1
  Fe  Fe4  1  0.99959800  0.57406500  0.87410800  1
  Fe  Fe5  1  0.49959800  0.42593500  0.12589200  1
  Fe  Fe6  1  0.49959800  0.92593500  0.37410800  1
  Fe  Fe7  1  0.99959800  0.07406500  0.62589200  1
  N  N8  1  0.39052900  0.58991100  0.37599400  1
  N  N9  1  0.89052900  0.41008900  0.62400600  1
  N  N10  1  0.89052900  0.91008900  0.87599400  1
  N  N11  1  0.39052900  0.08991100  0.12400600  1
  N  N12  1  0.37693700  0.58010700  0.87054100  1
  N  N13  1  0.87693700  0.41989300  0.12945900  1
  N  N14  1  0.87693700  0.91989300  0.37054100  1
  N  N15  1  0.37693700  0.08010700  0.62945900  1
