From: Robert H. <ha...@st...> - 2020-10-29 11:22:21
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Thank you, John. That was very helpful. I will get this into the documentation. Also, you don't necessarily have to unzip the archive. You can use Jmol's zip-entry syntax: load c:/temp/foo.zip|NBODATA.36 *PNBOs: WH6...b3lyp/vdzNBO type PNBO* And, also, note that since the .36 file reader will automatically access .31 and .46, after this is done, just like for loading .31 explicitly, you can then use the NBO TYPE command to switch to the other types directly. There is no need to ever LOAD the .31 file. Bob |