# generated using pymatgen
data_PuB3Mo
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.11204880
_cell_length_b   5.51366518
_cell_length_c   6.90360272
_cell_angle_alpha   76.75948519
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   PuB3Mo
_chemical_formula_sum   'Pu2 B6 Mo2'
_cell_volume   115.30857099
_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
  Pu  Pu0  1  0.25000000  0.33452660  0.70064335  1.0
  Pu  Pu1  1  0.75000000  0.66547340  0.29935665  1.0
  B  B2  1  0.25000000  0.92414890  0.52835107  1.0
  B  B3  1  0.75000000  0.07585110  0.47164893  1.0
  B  B4  1  0.25000000  0.91276363  0.00538436  1.0
  B  B5  1  0.75000000  0.08723637  0.99461564  1.0
  B  B6  1  0.25000000  0.58271710  0.00697940  1.0
  B  B7  1  0.75000000  0.41728290  0.99302060  1.0
  Mo  Mo8  1  0.25000000  0.18680794  0.21587392  1.0
  Mo  Mo9  1  0.75000000  0.81319206  0.78412608  1.0