%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                 -0.27622700   -0.56779200    0.06082100
 C                 -1.70786500   -0.12838000    0.39032000
 C                 -2.66135800    0.38172100   -0.47943900
 C                 -1.98152400   -0.29989000    1.75974400
 C                 -3.91728600    0.72290900    0.02624300
 H                 -2.43662900    0.50804100   -1.53381000
 C                 -3.22863500    0.02650300    2.27978400
 C                 -4.17577700    0.53572600    1.38743100
 H                 -4.69250800    1.12468800   -0.61350000
 H                 -3.47425600   -0.09442100    3.32749300
 C                  0.23808200   -0.96736800    1.44772500
 C                  1.50813100   -1.41143700    1.78786600
 C                 -0.77077800   -0.81900400    2.41746600
 C                  1.77634400   -1.71987900    3.12300200
 H                  2.27768800   -1.51862900    1.03004300
 C                 -0.52510800   -1.13086000    3.74969800
 C                  0.75901500   -1.57799800    4.07135900
 H                  2.75236800   -2.06808100    3.43583900
 H                 -1.27907500   -1.03314200    4.52081300
 C                 -0.27538300   -1.75636200   -0.90333800
 C                  0.36362600   -1.68635300   -2.14234200
 C                 -0.93356200   -2.94172000   -0.54612700
 C                  0.34335100   -2.78547200   -3.00572100
 H                  0.87884500   -0.77750500   -2.42868200
 C                 -0.94913500   -4.03053100   -1.41163400
 H                 -1.43371800   -3.01433400    0.41636500
 C                 -0.31160500   -3.97209100   -2.66115700
 H                  0.85017100   -2.71383300   -3.96533800
 H                 -1.46197900   -4.94218000   -1.11382000
 O                  0.49181600    0.46501900   -0.54253400
 C                  0.65951300    1.66617400    0.22894700
 H                 -0.31199700    1.98121600    0.63457800
 H                  1.33340100    1.48271300    1.07519900
 C                  1.21639600    2.72155300   -0.68763000
 C                  2.46270900    3.30652700   -0.45324300
 C                  0.48158600    3.13157500   -1.80892800
 C                  2.96143100    4.28797100   -1.31347600
 H                  3.05199000    2.99225100    0.40518700
 C                  0.98361000    4.10469300   -2.66819200
 H                 -0.48454400    2.67478700   -2.00880500
 C                  2.23155600    4.70419600   -2.43277200
 H                  3.93466900    4.73043000   -1.11408000
 H                  0.40154900    4.40811400   -3.53562000
 C                  2.75410500    5.78359600   -3.35154100
 H                  2.51312300    5.56880500   -4.39856000
 H                  2.30597600    6.75654000   -3.11011600
 H                  3.84010400    5.89297100   -3.26656100
 C                 -0.35545500   -5.15030200   -3.60513800
 H                 -1.32793300   -5.21358100   -4.11082900
 H                  0.41413800   -5.07322100   -4.37973700
 H                 -0.20887300   -6.09573500   -3.07080500
 N                 -5.50380700    0.89332500    1.90610600
 O                 -6.33333600    1.34725900    1.11579100
 O                 -5.72081400    0.72085800    3.10716700
 N                  1.05320800   -1.91034500    5.47271400
 O                  0.14692600   -1.78557800    6.29877600
 O                  2.18989000   -2.29594800    5.75204100


