%nprocshared=24
%mem=41GB
#p b3lyp 6-311+G(d,p) empiricaldispersion=gd3 scrf=(pcm,solvent=methylpropanoate) nosymm scf=maxcyc=512

Single point

-1 1
 O                  0.07809700   -1.45488200   -1.08357700
 C                  1.11371300   -0.71929900   -0.56002400
 H                  1.50528900   -1.12067000    0.40718500
 H                  2.01156600   -0.72159100   -1.22537200
 C                  0.78372400    0.75437900   -0.30152600
 C                  1.73905800    1.62777700    0.23845500
 C                 -0.47631000    1.27214900   -0.60851800
 C                  1.44315300    2.97095400    0.46505200
 H                  2.73119300    1.24796800    0.48274100
 C                 -0.77488400    2.61893700   -0.37996300
 H                 -1.21932300    0.59409800   -1.01485200
 C                  0.17551300    3.49262500    0.16052800
 H                  2.20389400    3.62834900    0.88390700
 H                 -1.76563300    2.99803200   -0.62699500
 C                 -0.15479200    4.94199900    0.43801900
 H                 -1.00045300    5.28391000   -0.16893900
 H                 -0.42667600    5.09797300    1.49123800
 H                  0.69882500    5.59732300    0.22768700
 O                 -2.04458200   -1.68999900    0.39650600
 H                 -1.18588300   -1.52341600   -0.12868800
 C                 -2.69202000   -2.74314100   -0.28331100
 H                 -2.00296700   -3.56881700   -0.51815500
 H                 -3.49803100   -3.13872500    0.35148000
 H                 -3.15662300   -2.41966800   -1.23446400
 O                  0.55642200   -3.94960700   -0.51299000
 H                  0.39509900   -2.98947600   -0.81509200
 C                  0.54540300   -3.90696200    0.89749700
 H                 -0.28302100   -3.29746000    1.28770800
 H                  0.43184600   -4.92919800    1.28717200
 H                  1.48351900   -3.49966600    1.32152900


