pyclupan: 4-1-8
   1.00000000000000
     0.0000000000000000   -2.0455196405866616   -2.0455196405866616
    -3.8690729241365656   -0.0000000000000001   -0.0000000000000001
     0.0000000000000000    4.1566339368342735   -4.1566339368342735
   Cu   Ag   Au
     1     2     1
Direct
  0.5000000000000000  0.5000000000000000  0.7545429896671365
  0.5000000000000000  0.5000000000000000  0.2515015227932835
  0.0000000000000000  0.0000000000000000  0.5106156309868339
  0.0000000000000000  0.0000000000000000  0.9833398565527460

  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
