BSSE input MPI abort communication error and XYG3 functional


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2:19:03 AM PDT - Wed, Aug 12th 2015
Hi,

I am sorry.

6

C 0.000000    0.000000    1.917041
H 0.000000    0.000000    0.828041
H 0.000000    1.026537    2.280557
H -0.889007   -0.513268    2.280557
H 0.889007   -0.513268    2.280557
H 0.000000    0.000000  -19.171959


I also forgot to say that I have any problems when I compute without BSSE directive.