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

Single point

0 1
 C                 -0.38239100   -0.23064600   -0.39304000
 C                 -1.74160400    0.12770700    0.23244000
 C                 -2.67823900    0.80306900   -0.56772700
 C                 -2.02198300   -0.04949900    1.59319800
 C                 -3.87798700    1.26025100   -0.03779700
 H                 -2.46049000    0.97039500   -1.61668600
 C                 -3.22089200    0.39931700    2.14340700
 H                 -1.30287900   -0.53678100    2.24110200
 C                 -4.13621900    1.04409800    1.31654400
 H                 -4.60559700    1.77626100   -0.65141000
 H                 -3.44394400    0.25989700    3.19364500
 C                  0.44168600   -1.26406000    0.40271200
 C                  1.82379700   -1.08265200    0.55095600
 C                 -0.14128000   -2.44508900    0.88970600
 C                  2.60592000   -2.03702500    1.19389100
 H                  2.28927600   -0.18904000    0.15324900
 C                  0.62453400   -3.41043300    1.53243200
 H                 -1.20500700   -2.61691200    0.76743600
 C                  1.99393100   -3.19005300    1.68164900
 H                  3.67295300   -1.89847000    1.31556000
 H                  0.17846300   -4.32028900    1.91361200
 C                 -0.53349600   -0.81429000   -1.80938700
 C                  0.37636800   -0.47205900   -2.81522000
 C                 -1.52845300   -1.75658700   -2.09842900
 C                  0.28230700   -1.05344800   -4.07972700
 H                  1.15471100    0.25278500   -2.60768700
 C                 -1.61459600   -2.33474800   -3.36327400
 H                 -2.25126600   -2.03785900   -1.33805400
 C                 -0.71265000   -1.99238400   -4.37950800
 H                  0.99919700   -0.77130600   -4.84752600
 H                 -2.39767600   -3.06219500   -3.56380500
 O                  0.36156200    0.98369500   -0.55235400
 C                  0.50251300    1.82761200    0.60719000
 H                 -0.41727000    2.41131700    0.73968300
 H                  0.65063300    1.22538900    1.51155200
 C                  1.68962500    2.71857500    0.36277500
 C                  2.88693100    2.53651900    1.06119300
 C                  1.62658000    3.72345100   -0.61137400
 C                  3.99459000    3.34497100    0.79799300
 H                  2.95616400    1.75576000    1.81544400
 C                  2.73430000    4.52483200   -0.87572900
 H                  0.70466500    3.86910500   -1.16908600
 C                  3.93690000    4.35229700   -0.17253400
 H                  4.91657500    3.18856600    1.35309300
 H                  2.66857900    5.29843000   -1.63754400
 C                  5.12286900    5.24894100   -0.43989200
 H                  5.20225000    5.50084000   -1.50309100
 H                  5.03274400    6.19459800    0.11084300
 H                  6.06116700    4.77779600   -0.12955000
 C                 -0.82878900   -2.59404400   -5.75977300
 H                 -1.48260300   -1.98661500   -6.39966200
 H                  0.14645600   -2.65290500   -6.25438600
 H                 -1.25532400   -3.60207900   -5.72315000
 N                 -5.40405900    1.51747500    1.88684300
 O                 -6.19729800    2.08916400    1.13671800
 O                 -5.60928000    1.31879300    3.08571600
 N                  2.80918500   -4.19927000    2.36432800
 O                  2.24608200   -5.21366100    2.78219900
 O                  4.01674200   -3.98255300    2.48741000

solventname=PMMA
eps=3.9
epsinf=2.222

