waterdimer scm output jpg
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Now select one molecule Shift Click 3 secs and select New Fragment Do the same for the other molecule and run the job After completion select Output on the SCM menu and go to Bonding Energy Decomposition This will take you to the part of the output where the energy is given In this case we see a

Embedded XML Output JPG
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CSharp in this case So the fully qualified XML file name is CSharp Users xml The output shows that we were able to read and parse the file successfully That s all there is to it Happy LINQing

output jpg
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