# generated using pymatgen
data_Li3FeN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75439980
_cell_length_b   4.81862954
_cell_length_c   5.81750324
_cell_angle_alpha   113.22987334
_cell_angle_beta   114.11874331
_cell_angle_gamma   90.00000833
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3FeN2
_chemical_formula_sum   'Li6 Fe2 N4'
_cell_volume   109.69728004
_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
  Li  Li0  1  0.74935232  0.50000000  -0.00000000  1
  Li  Li1  1  0.25064768  0.50000000  0.00000000  1
  Li  Li2  1  0.49371570  0.74155456  0.48425139  1
  Li  Li3  1  0.00946531  0.25844544  0.51574861  1
  Li  Li4  1  0.99053469  0.74155456  0.48425139  1
  Li  Li5  1  0.50628430  0.25844544  0.51574861  1
  Fe  Fe6  1  0.74622573  -0.00000000  -0.00000000  1
  Fe  Fe7  1  0.25377427  0.00000000  0.00000000  1
  N  N8  1  0.88662460  0.10986546  0.77325019  1
  N  N9  1  0.61696869  0.34337149  0.23393637  1
  N  N10  1  0.11337540  0.89013454  0.22674981  1
  N  N11  1  0.38303131  0.65662851  0.76606363  1
