%nprocshared=8
%mem=22GB
#p b3lyp 6-311+G(d,p) empiricaldispersion=gd3 scrf=(pcm,solvent=methylbutanoate) nosymm scf=maxcyc=512

Single point

-1 1
 O                  0.08079800   -1.45533900   -1.07836100
 C                  1.11496500   -0.71758500   -0.55576000
 H                  1.50657800   -1.11630800    0.41262200
 H                  2.01333600   -0.71986700   -1.22050400
 C                  0.78294600    0.75620500   -0.30045500
 C                  1.73761000    1.63281600    0.23541500
 C                 -0.47868800    1.27073500   -0.60627900
 C                  1.43960400    2.97598900    0.45924700
 H                  2.73094800    1.25545400    0.47868600
 C                 -0.77935500    2.61747300   -0.38050200
 H                 -1.22104100    0.59012900   -1.00954400
 C                  0.17035600    3.49437400    0.15594500
 H                  2.19992100    3.63591700    0.87496000
 H                 -1.77136800    2.99402100   -0.62644700
 C                 -0.16244200    4.94370200    0.43074900
 H                 -1.00932700    5.28277000   -0.17613700
 H                 -0.43370900    5.10147500    1.48388700
 H                  0.68967500    5.60029900    0.21818100
 O                 -2.04455100   -1.69565500    0.39705900
 H                 -1.18495700   -1.52643700   -0.12580100
 C                 -2.68652700   -2.75104700   -0.28426900
 H                 -1.99359400   -3.57351100   -0.51908900
 H                 -3.49151400   -3.15076300    0.34936300
 H                 -3.15163000   -2.42892100   -1.23569300
 O                  0.56364500   -3.94892400   -0.50749200
 H                  0.40099800   -2.98933800   -0.81074000
 C                  0.54965000   -3.90486800    0.90272900
 H                 -0.28083700   -3.29675500    1.29078700
 H                  0.43757200   -4.92701000    1.29327400
 H                  1.48605300   -3.49513400    1.32840600


