# generated using pymatgen
data_Pu4MnFe3B16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.39145879
_cell_length_b   5.93031211
_cell_length_c   11.47856231
_cell_angle_alpha   89.95643574
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Pu4MnFe3B16
_chemical_formula_sum   'Pu4 Mn1 Fe3 B16'
_cell_volume   230.86147459
_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
  Pu  Pu0  1  0.00000000  0.12601100  0.64758198  1.0
  Pu  Pu1  1  0.00000000  0.87231525  0.35009899  1.0
  Pu  Pu2  1  0.00000000  0.62644509  0.84880566  1.0
  Pu  Pu3  1  0.00000000  0.37348513  0.15323405  1.0
  Mn  Mn4  1  0.00000000  0.12776951  0.91427150  1.0
  Fe  Fe5  1  0.00000000  0.87546399  0.08427332  1.0
  Fe  Fe6  1  0.00000000  0.63035212  0.58757917  1.0
  Fe  Fe7  1  0.00000000  0.36911074  0.41259578  1.0
  B  B8  1  0.50000000  0.36320688  0.96824470  1.0
  B  B9  1  0.50000000  0.63856270  0.03418670  1.0
  B  B10  1  0.50000000  0.85941455  0.53270802  1.0
  B  B11  1  0.50000000  0.14007922  0.46679287  1.0
  B  B12  1  0.50000000  0.47577903  0.68912531  1.0
  B  B13  1  0.50000000  0.52462751  0.31062948  1.0
  B  B14  1  0.50000000  0.97329762  0.80878379  1.0
  B  B15  1  0.50000000  0.02350492  0.19093412  1.0
  B  B16  1  0.50000000  0.28323034  0.81430259  1.0
  B  B17  1  0.50000000  0.71907474  0.18393438  1.0
  B  B18  1  0.50000000  0.77993363  0.68332293  1.0
  B  B19  1  0.50000000  0.21956506  0.31653523  1.0
  B  B20  1  0.50000000  0.38901116  0.54528016  1.0
  B  B21  1  0.50000000  0.61163208  0.45426949  1.0
  B  B22  1  0.50000000  0.88608576  0.95524723  1.0
  B  B23  1  0.50000000  0.11204298  0.04726456  1.0