pyclupan: 6-7-40
   1.00000000000000
    -1.9361125439748978   -3.9555695908896245   -1.9361125439748976
    -4.0761051734080143    2.0265080402334044    2.0419831848353791
     2.0419831848353791    2.0265080402334044   -4.0761051734080143
   Cu   Au
     2     4
Direct
  0.5000000000000000  0.5001503585766187  0.4998496414233813
  0.5000000000000000  0.1665163080900456  0.8334836919099544
  0.0000000000000000  0.0063341603350295  0.9936658396649705
  0.5000000000000000  0.8333333333333357  0.1666666666666643
  0.0000000000000000  0.6603325063316348  0.3396674936683652
  0.0000000000000000  0.3333333333333357  0.6666666666666643

  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
  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
