On Mon, Sep 15, 2008, moitrayee.mbu.iisc.ernet.in wrote:
> I prepared the .prepc file for the cluster...
You don't say how you got the prepc file. If you used antechamber, I
will just repeat what was said earlier: antechamber won't work for
transition metals. You will have to prepare the unit by hand.
...dac
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Received on Wed Sep 17 2008 - 03:07:30 PDT
