# generated using pymatgen
data_AcFeN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.61489713
_cell_length_b   6.61489736
_cell_length_c   5.42481551
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   145.30438932
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AcFeN3
_chemical_formula_sum   'Ac2 Fe2 N6'
_cell_volume   135.11659376
_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
  Ac  Ac0  1  0.37020501  0.62979499  0.25000000  1.0
  Ac  Ac1  1  0.62979499  0.37020501  0.75000000  1.0
  Fe  Fe2  1  0.91266803  0.08733197  0.75000000  1.0
  Fe  Fe3  1  0.08733197  0.91266803  0.25000000  1.0
  N  N4  1  0.47356984  0.85482793  0.75000000  1.0
  N  N5  1  0.14517207  0.52643016  0.75000000  1.0
  N  N6  1  0.00000000  0.00000000  0.00000000  1.0
  N  N7  1  0.52643016  0.14517207  0.25000000  1.0
  N  N8  1  0.85482793  0.47356984  0.25000000  1.0
  N  N9  1  0.00000000  0.00000000  0.50000000  1.0