I am running antechamber to determine resp charges
from the output file of a gaussian calculation for a
molecule that has 177 atoms. I get an error (see
below) after running antechamber. I would appreciate
any help on this matter.
antechamber -fi gout -fo mol2 -i gaussianoutput.log -o
output.mol2 -c resp -nc 1
Amber8 Module: resp
PGFIO-F-217/formatted read/unit=5/attempt to read past
end of file.
File name = ANTECHAMBER_RESP1.IN formatted,
sequential access record = 1
In source file _resp.f, at line number 385
Amber8 Module: resp
PGFIO-F-217/formatted read/unit=5/attempt to read past
end of file.
File name = ANTECHAMBER_RESP2.IN formatted,
sequential access record = 1
In source file _resp.f, at line number 385
Cannot open charge file QOUT , exit
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Received on Wed Aug 03 2005 - 20:53:00 PDT
