api/nblib/listed_forces/tests/refdata/FourCenter_ListedForcesProperDihedralTest_CheckListed_1.xml

   1 <?xml version="1.0"?>
   2 <?xml-stylesheet type="text/xsl" href="referencedata.xsl"?>
   3 <ReferenceData>
   4   <Real Name="Epot">11.117714323462188</Real>
   5   <Sequence Name="forces">
   6     <Int Name="Length">4</Int>
   7     <Vector>
   8       <Real Name="X">273.20508075688775</Real>
   9       <Real Name="Y">0</Real>
  10       <Real Name="Z">0</Real>
  11     </Vector>
  12     <Vector>
  13       <Real Name="X">-858.64453952164718</Real>
  14       <Real Name="Y">0</Real>
  15       <Real Name="Z">0</Real>
  16     </Vector>
  17     <Vector>
  18       <Real Name="X">957.99184161506105</Real>
  19       <Real Name="Y">0</Real>
  20       <Real Name="Z">0</Real>
  21     </Vector>
  22     <Vector>
  23       <Real Name="X">-372.55238285030157</Real>
  24       <Real Name="Y">0</Real>
  25       <Real Name="Z">0</Real>
  26     </Vector>
  27   </Sequence>
  28 </ReferenceData>