%nprocshared=24
%mem=41GB
#p b3lyp opt freq=noraman 6-31G(d) scrf=(solvent=methylbutanoate,pcm) nosymm empiricaldispersion=gd3 scf=maxcyc=512

Opt freq

0 1
 C                 -0.53184800   -0.38449200   -1.08767400
 C                 -1.94070000   -0.52318900   -0.53490400
 C                 -3.00109900    0.08180400   -1.23073100
 C                 -2.22379800   -1.13988600    0.68698800
 C                 -4.29604000    0.05615500   -0.73125800
 H                 -2.79887400    0.60542800   -2.16156500
 C                 -3.52112400   -1.17801800    1.20498900
 H                 -1.42257600   -1.60942900    1.24935000
 C                 -4.56752900   -0.57990600    0.49120300
 H                 -5.11658800    0.52061800   -1.26965400
 H                 -3.69929000   -1.67013600    2.15377000
 C                  0.44549500   -1.50148200   -0.74520100
 C                  1.79854100   -1.23262600   -0.50776900
 C                  0.05316900   -2.84623500   -0.75346600
 C                  2.71760200   -2.24895500   -0.26270200
 H                  2.14283900   -0.20323600   -0.50904600
 C                  0.95848500   -3.87713300   -0.52044100
 H                 -0.98646900   -3.10152600   -0.93948200
 C                  2.32589300   -3.60855600   -0.27085900
 H                  3.74705900   -1.97426600   -0.06699100
 H                  0.59092300   -4.89606900   -0.52935400
 N                  3.24066300   -4.63034100   -0.05692700
 C                  4.56579700   -4.29562800    0.44568300
 C                  2.74905200   -5.98191900    0.17209900
 H                  4.53260700   -3.77916800    1.41811300
 H                  5.10274800   -3.65324400   -0.26157000
 H                  2.09069100   -6.05107500    1.05259300
 H                  2.19254200   -6.34932000   -0.69764300
 C                 -6.20793700   -1.18852400    2.12653900
 H                 -5.97297400   -2.26006900    2.10681900
 H                 -5.68832300   -0.71874100    2.97100700
 O                  0.02929500    0.91663100   -0.76090500
 C                  0.03998700    1.26978800    0.63919300
 H                 -0.98100100    1.51365400    0.95759300
 H                  0.38519200    0.41681800    1.23386400
 C                  0.96239900    2.44744500    0.80050000
 C                  2.22987600    2.29824300    1.37189200
 C                  0.57716600    3.71551000    0.34212800
 C                  3.09143700    3.39122000    1.49010400
 H                  2.54786800    1.31988200    1.72497800
 C                  1.44229700    4.80192300    0.45479300
 H                 -0.39477100    3.84099600   -0.12828700
 C                  2.71220100    4.66069200    1.03643200
 H                  4.07270500    3.25444600    1.93875000
 H                  1.12877900    5.77695700    0.08832200
 C                  3.62918200    5.85152600    1.18880300
 H                  3.55578800    6.52578100    0.32839700
 H                  3.36869300    6.43698100    2.08053800
 H                  4.67434100    5.54284100    1.29377000
 C                 -0.39878900    3.32969500   -3.11938800
 H                 -0.88141100    4.08133700   -3.75235100
 H                  0.43021700    3.81357100   -2.58100100
 H                  0.02436000    2.55147800   -3.77325900
 O                 -1.38358100    2.81400300   -2.23275900
 H                 -0.92883900    2.14512500   -1.67775100
 H                 -0.60979900   -0.31952700   -2.18021400
 H                  5.14640500   -5.21211100    0.56251800
 H                  3.59817700   -6.65016600    0.32428600
 H                 -7.28440400   -1.05555200    2.24436300
 O                 -5.87023200   -0.55917400    0.89178200


