# generated using pymatgen
data_AcN
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28027796
_cell_length_b   4.28027824
_cell_length_c   6.29513537
_cell_angle_alpha   89.99995608
_cell_angle_beta   90.00002220
_cell_angle_gamma   120.00002843
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AcN
_chemical_formula_sum   'Ac2 N2'
_cell_volume   99.88023486
_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  0.00000093  -0.00000015  0.98489493  1.0
  Ac  Ac1  1  0.33333083  0.66666367  0.48489334  1.0
  N  N2  1  0.99999964  0.99999728  0.39009851  1.0
  N  N3  1  0.33333360  0.66666720  0.89011322  1.0