NWChem isn't running properly


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"#" sign in title
Khun Wasut
The "#" in the title string is causing the NWChem input file to ignore the rest of the input file.

How to fix:
Either replace "#" with something else or put the backslash "\" sign just before it, e.g.

"HCl+4H2O SIP Form MP2/cc-pVTZ Optimization Run \#1"