%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                 -0.52749400   -0.39039200   -1.08240600
 C                 -1.93463800   -0.52242600   -0.52248600
 C                 -2.98799800    0.12205600   -1.19374200
 C                 -2.22005100   -1.16660200    0.68393100
 C                 -4.27951800    0.10449800   -0.68653500
 H                 -2.78084500    0.67272000   -2.10780000
 C                 -3.51511100   -1.19731100    1.20860700
 H                 -1.42269300   -1.66321000    1.22834700
 C                 -4.55477400   -0.56202500    0.51839600
 H                 -5.09491500    0.60075800   -1.20365700
 H                 -3.69616000   -1.71247000    2.14470400
 C                  0.44782700   -1.51062300   -0.74485200
 C                  1.79873600   -1.24382600   -0.49552700
 C                  0.05540100   -2.85490000   -0.76963100
 C                  2.71530900   -2.26290000   -0.25299400
 H                  2.14267000   -0.21434800   -0.48883300
 C                  0.95869400   -3.88781100   -0.53897300
 H                 -0.98282600   -3.10757900   -0.96711300
 C                  2.32330300   -3.62134600   -0.27627400
 H                  3.74398700   -1.99074700   -0.04957300
 H                  0.59181300   -4.90682900   -0.56191500
 N                  3.23686100   -4.64623500   -0.06382200
 C                  4.55850800   -4.31624800    0.44746500
 C                  2.74308600   -5.99835600    0.14944200
 H                  4.52202200   -3.80701800    1.42399500
 H                  5.09918700   -3.66886100   -0.25257100
 H                  2.07500800   -6.07514000    1.02236700
 H                  2.19596000   -6.35916400   -0.72920000
 C                 -6.19538600   -1.18279900    2.14618800
 H                 -5.98096200   -2.25835500    2.09949000
 H                 -5.66182100   -0.74440300    2.99944000
 O                  0.04027500    0.90741000   -0.75864600
 C                  0.03986600    1.26850100    0.63818300
 H                 -0.98447600    1.50776400    0.94945500
 H                  0.38681300    0.42078200    1.24007400
 C                  0.95328600    2.45320400    0.79860800
 C                  2.21209400    2.31909800    1.39132800
 C                  0.56640000    3.71317300    0.32009100
 C                  3.06406800    3.41904900    1.51157800
 H                  2.53092400    1.34632500    1.75925100
 C                  1.42220700    4.80622500    0.43513800
 H                 -0.39822600    3.82648400   -0.16828400
 C                  2.68324200    4.68040000    1.03850500
 H                  4.03919100    3.29416500    1.97709900
 H                  1.10787300    5.77507400    0.05304800
 C                  3.58898900    5.87961100    1.19267500
 H                  3.52858200    6.54153800    0.32162800
 H                  3.30789300    6.47568600    2.07109900
 H                  4.63428900    5.58007900    1.32132900
 C                 -0.35973600    3.31455200   -3.15401000
 H                 -0.84740200    4.05622200   -3.79497200
 H                  0.45936400    3.81184200   -2.61221100
 H                  0.07959700    2.53884300   -3.80081400
 O                 -1.34420900    2.79209300   -2.27335300
 H                 -0.88658900    2.13670000   -1.70545500
 H                 -0.61044000   -0.32599000   -2.17471700
 H                  5.13894800   -5.23372200    0.55970100
 H                  3.59029100   -6.66861400    0.30526700
 H                 -7.26855900   -1.03346000    2.27573500
 O                 -5.85525800   -0.53029400    0.92720900

solventname=PMMA
eps=3.9
epsinf=2.222

