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

Single point

0 1
 C                  0.06920600   -0.26550500    0.19164800
 C                 -0.91635500   -1.14853000    0.97612000
 C                 -1.59335300   -0.85598200    2.15341000
 C                 -2.44818400   -1.82169800    2.69866100
 C                 -2.61929600   -3.05845400    2.06543600
 C                 -1.94222900   -3.35078000    0.87844300
 C                 -1.08874900   -2.38799000    0.33704800
 H                 -2.07775800   -4.31045500    0.38724900
 H                 -2.98526500   -1.60649200    3.61799300
 H                 -1.47718600    0.10834500    2.64091300
 C                 -0.59822100    1.05945600   -0.20676800
 C                 -1.20442200    1.20928800   -1.46128400
 C                 -1.86608500    2.38740700   -1.80385600
 C                 -1.95253500    3.46258700   -0.91057200
 C                 -1.35111900    3.31060200    0.34386600
 C                 -0.69342300    2.13126200    0.69441600
 H                 -0.24576500    2.07203700    1.68093000
 H                 -1.39492100    4.12549700    1.06274600
 H                 -2.31863700    2.47266200   -2.78922100
 H                 -1.15511800    0.40143700   -2.18285800
 C                  1.32310700    0.00120100    1.12229900
 H                  0.96282800    0.26928400    2.11868500
 C                  2.13997300   -1.20512800    1.28244100
 N                  2.79221800   -2.15423200    1.42355200
 C                  2.22075900    1.15685900    0.64050700
 O                  2.70113600    1.25981400   -0.46509900
 O                  2.39410900    2.04062300    1.63104900
 C                  3.17987700    3.20782900    1.29538800
 H                  4.17914900    2.90961100    0.97065200
 H                  3.22801000    3.79567200    2.21085600
 H                  2.68545800    3.76836100    0.49836400
 C                  0.41465000   -1.18071800   -0.99142800
 C                 -0.26735600   -2.40793100   -0.87684600
 C                 -0.10703900   -3.40705800   -1.83761400
 C                  0.74132000   -3.16770100   -2.92091600
 C                  1.41472000   -1.94673200   -3.03864900
 C                  1.25539000   -0.94394000   -2.07444600
 H                  1.78199500   -0.00227000   -2.16297200
 H                  2.07033200   -1.77233200   -3.88721400
 H                 -0.63339000   -4.35307400   -1.74498100
 C                 -2.68995400    4.72770100   -1.27952500
 H                 -2.59822500    4.94692500   -2.34870000
 H                 -3.76148600    4.63668400   -1.05750000
 H                 -2.31296100    5.59009000   -0.71991500
 H                 -3.28671000   -3.79739200    2.50005700
 H                  0.87788100   -3.93482400   -3.67823800


