> NSTEP ENERGY RMS GMAX NAME NUMBER
> 1 9.4604E+09 1.5560E+09 2.7921E+11 H32 1126
> 1-4 VDW = *************
> Please suggest me how I will solve this problem
It looks like there is a vdw problem around atom 1126, named H32.
It could be just the starting structure.
Bill
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Received on Wed Mar 03 2010 - 10:30:04 PST
