# generated using pymatgen
data_PuTaN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.26861797
_cell_length_b   5.72698201
_cell_length_c   10.93876755
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PuTaN2
_chemical_formula_sum   'Pu4 Ta4 N8'
_cell_volume   204.76625010
_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
  Pu  Pu0  1  0.25000000  0.58058830  0.86354932  1.0
  Pu  Pu1  1  0.75000000  0.41941170  0.13645068  1.0
  Pu  Pu2  1  0.75000000  0.91941170  0.36354932  1.0
  Pu  Pu3  1  0.25000000  0.08058830  0.63645068  1.0
  Ta  Ta4  1  0.25000000  0.92262614  0.10871414  1.0
  Ta  Ta5  1  0.75000000  0.07737386  0.89128586  1.0
  Ta  Ta6  1  0.75000000  0.57737386  0.60871414  1.0
  Ta  Ta7  1  0.25000000  0.42262614  0.39128586  1.0
  N  N8  1  0.25000000  0.66694830  0.24565167  1.0
  N  N9  1  0.75000000  0.33305170  0.75434833  1.0
  N  N10  1  0.75000000  0.83305170  0.74565167  1.0
  N  N11  1  0.25000000  0.16694830  0.25434833  1.0
  N  N12  1  0.25000000  0.73835663  0.50768582  1.0
  N  N13  1  0.75000000  0.26164337  0.49231418  1.0
  N  N14  1  0.75000000  0.76164337  0.00768582  1.0
  N  N15  1  0.25000000  0.23835663  0.99231418  1.0