pyclupan: 1-0-2
   1.00000000000000
     2.0779888898408561   -2.0779888898408561    0.0000000000000000
    -2.0779888898408561    0.0000000000000000   -2.0779888898408561
     2.0779888898408561    2.0779888898408561    0.0000000000000000
   Au
     1
Direct
  0.0000000000000000  0.0000000000000000  0.0000000000000000

  0.00000000E+00  0.00000000E+00  0.00000000E+00
