# generated using pymatgen
data_NaPuB12
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.84155656
_cell_length_b   5.84155618
_cell_length_c   5.84155544
_cell_angle_alpha   60.00000423
_cell_angle_beta   60.00000634
_cell_angle_gamma   59.99999559
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NaPuB12
_chemical_formula_sum   'Na1 Pu1 B12'
_cell_volume   140.95181381
_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
  Na  Na0  1  0.50000000  0.50000000  0.50000000  1.0
  Pu  Pu1  1  0.00000000  0.00000000  0.00000000  1.0
  B  B2  1  0.39955285  0.10044715  0.10044715  1.0
  B  B3  1  0.89955285  0.60044715  0.60044715  1.0
  B  B4  1  0.39955285  0.39955285  0.10044715  1.0
  B  B5  1  0.89955285  0.89955285  0.60044715  1.0
  B  B6  1  0.10044715  0.39955285  0.10044715  1.0
  B  B7  1  0.60044715  0.89955285  0.60044715  1.0
  B  B8  1  0.10044715  0.10044715  0.39955285  1.0
  B  B9  1  0.60044715  0.60044715  0.89955285  1.0
  B  B10  1  0.39955285  0.10044715  0.39955285  1.0
  B  B11  1  0.89955285  0.60044715  0.89955285  1.0
  B  B12  1  0.10044715  0.39955285  0.39955285  1.0
  B  B13  1  0.60044715  0.89955285  0.89955285  1.0