# generated using pymatgen
data_AcCeN4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.95733294
_cell_length_b   3.95733375
_cell_length_c   6.40983803
_cell_angle_alpha   100.39968148
_cell_angle_beta   100.39968197
_cell_angle_gamma   63.32601083
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AcCeN4
_chemical_formula_sum   'Ac1 Ce1 N4'
_cell_volume   87.65768049
_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
  Ac  Ac0  1  0.79103562  0.20896438  0.25000000  1.0
  Ce  Ce1  1  0.23270942  0.76729158  0.74999900  1.0
  N  N2  1  0.16375141  0.43849219  0.03644757  1.0
  N  N3  1  0.56150781  0.83624859  0.46355343  1.0
  N  N4  1  0.42803666  0.17704091  0.57339368  1.0
  N  N5  1  0.82295909  0.57196334  0.92660632  1.0