pyclupan: 3-1-5
   1.00000000000000
     0.0000000000000000    2.0565971072593903    2.0565971072593898
     4.1723833082800468    0.0000000000000000    0.0000000000000000
    -2.0861916541400234    2.0858076489322022   -4.1424047561915911
   Ag   Au
     2     1
Direct
  0.6665268141323182  0.6665268141323182  0.3330536282646293
  0.3334731858676818  0.3334731858676818  0.6669463717353707
  0.0000000000000000  0.0000000000000000  0.0000000000000000

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