# generated using pymatgen
data_PuB2C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26497664
_cell_length_b   5.26497664
_cell_length_c   5.26497726
_cell_angle_alpha   77.46099120
_cell_angle_beta   77.46099120
_cell_angle_gamma   77.46099267
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PuB2C
_chemical_formula_sum   'Pu3 B6 C3'
_cell_volume   136.83571927
_cell_formula_units_Z   3
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  -0.00000000  -0.00000000  -0.00000000  1.0
  Pu  Pu1  1  0.68808872  0.68808872  0.68808872  1.0
  Pu  Pu2  1  0.31191128  0.31191128  0.31191128  1.0
  B  B3  1  0.22617898  0.77382102  0.50000000  1.0
  B  B4  1  0.50000000  0.22617898  0.77382102  1.0
  B  B5  1  0.77382102  0.50000000  0.22617898  1.0
  B  B6  1  0.50000000  0.77382102  0.22617898  1.0
  B  B7  1  0.22617898  0.50000000  0.77382102  1.0
  B  B8  1  0.77382102  0.22617898  0.50000000  1.0
  C  C9  1  -0.00000000  -0.00000000  0.50000000  1.0
  C  C10  1  0.50000000  -0.00000000  -0.00000000  1.0
  C  C11  1  -0.00000000  0.50000000  -0.00000000  1.0