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

Single point

-1 1
 O                  0.81547800   -1.30149600   -1.28358900
 C                  1.49980000   -0.35961400   -0.49763000
 H                  1.71367600   -0.75801800    0.51293000
 H                  2.47976600   -0.16911000   -0.96191300
 C                  0.77450500    0.97147500   -0.33036800
 C                  1.47654200    2.17996200   -0.29233100
 C                 -0.62018600    1.00684400   -0.17699900
 C                  0.81206700    3.39474000   -0.09900700
 H                  2.55801300    2.17736200   -0.42269400
 C                 -1.27814700    2.22093100    0.01384800
 H                 -1.17306500    0.06870100   -0.20421500
 C                 -0.57763800    3.43616800    0.05942300
 H                  1.38113300    4.32287700   -0.08063700
 H                 -2.36110900    2.22875100    0.12967300
 C                 -1.30542800    4.74124800    0.29084300
 H                 -2.22156800    4.80194100   -0.30880300
 H                 -1.60410000    4.85188800    1.34227700
 H                 -0.67834600    5.60277000    0.03624400
 O                 -1.16050500   -2.13531300    0.13771100
 H                  0.02041300   -1.65487700   -0.72355300
 C                 -0.81020500   -2.09608300    1.47739900
 H                 -0.58555400   -1.06579500    1.83294500
 H                 -1.61595100   -2.47355600    2.14661900
 H                  0.09008900   -2.70178600    1.73098700
 O                 -0.81971000   -4.64511400   -0.45048300
 H                 -1.05172900   -3.67557200   -0.24111900
 C                  0.58736200   -4.70314700   -0.43468400
 H                  0.99987700   -4.88705200    0.57799600
 H                  0.93010400   -5.53210400   -1.07390800
 H                  1.04639800   -3.77437900   -0.80512500

solventname=PMMA
eps=3.9
epsinf=2.222

