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

Single point

0 1
 C                 -0.07453400    0.17281300   -0.76005000
 C                 -1.30724800   -0.61751800   -0.31061500
 C                 -2.55017100   -0.34081900   -0.90908500
 C                 -1.30293800   -1.49344300    0.77684800
 C                 -3.72018800   -0.93370800   -0.45925800
 H                 -2.60618800    0.37931700   -1.71894400
 C                 -2.47205100   -2.11007400    1.22811800
 H                 -0.37355200   -1.71704000    1.28914800
 C                 -3.71144000   -1.84681000    0.61861500
 H                 -4.65976400   -0.66275700   -0.92997600
 H                 -2.39944400   -2.80552500    2.05587200
 C                  1.26847300   -0.38322000   -0.25495000
 C                  2.26242100    0.46859200    0.24505500
 C                  1.59227000   -1.73655300   -0.39723400
 C                  3.50914500   -0.01696800    0.62387800
 H                  2.06572600    1.53192700    0.32049100
 C                  2.83582900   -2.23663600   -0.01187200
 H                  0.85855700   -2.42512300   -0.80598300
 C                  3.82503800   -1.38560900    0.51603700
 H                  4.25804600    0.68247500    0.98245600
 H                  3.01936600   -3.29964300   -0.11607900
 C                  0.04498800    0.27227000   -2.29038100
 C                  0.64341500    1.39402400   -2.87934000
 C                 -0.33768600   -0.78614800   -3.12184500
 C                  0.82690300    1.46207200   -4.25961800
 H                  0.96641000    2.21788800   -2.25274600
 C                 -0.14546900   -0.71589000   -4.50240400
 H                 -0.79652200   -1.67150600   -2.69308900
 C                  0.43294700    0.41090000   -5.09927400
 H                  1.28931600    2.34719100   -4.69126500
 H                 -0.45553900   -1.55205400   -5.12511700
 N                  5.10773300   -1.84160200    0.89013800
 C                  5.56875600   -1.47208500    2.23858400
 C                  5.45530000   -3.22839500    0.57994900
 C                  7.06476500   -1.73594400    2.36975300
 H                  5.02835700   -2.05823500    3.00250200
 H                  5.37438800   -0.41481000    2.42774400
 C                  6.95730000   -3.43598300    0.76749600
 H                  4.90650700   -3.94026200    1.22224600
 H                  5.19920700   -3.44282800   -0.46224800
 H                  7.39562400   -1.54372100    3.39452300
 H                  7.61843500   -1.07155000    1.68642400
 O                  7.37460500   -3.09791400    2.08682700
 H                  7.21427400   -4.48831500    0.61574700
 H                  7.50550100   -2.82691200    0.03045500
 N                 -4.91903500   -2.41039300    1.07273500
 C                 -5.80345100   -3.00977200    0.06027500
 C                 -4.88176500   -3.22313100    2.28878000
 C                 -7.19043200   -3.24525900    0.64921400
 H                 -5.38848300   -3.97153500   -0.28811100
 H                 -5.89161600   -2.35014300   -0.80445200
 C                 -6.30246200   -3.45603000    2.80007000
 H                 -4.39233400   -4.19695900    2.11093300
 H                 -4.31741900   -2.69430000    3.06264600
 H                 -7.82383000   -3.76889000   -0.07261100
 H                 -7.65642300   -2.27724500    0.89548200
 O                 -7.12538800   -4.06704100    1.81154000
 H                 -6.28605900   -4.13249200    3.65943600
 H                 -6.74041400   -2.49459000    3.11423900
 O                 -0.22836900    1.55258900   -0.31312900
 C                 -0.56574200    1.74862400    1.07888700
 H                 -1.63426800    1.54748100    1.21730900
 H                 -0.00499500    1.04379300    1.70118000
 C                 -0.21945900    3.17051100    1.42972400
 C                  0.93636200    3.47122600    2.15806800
 C                 -1.03428500    4.22632700    0.99758200
 C                  1.27181800    4.79528400    2.44831300
 H                  1.58067700    2.66476900    2.50052600
 C                 -0.69322500    5.54679200    1.28462000
 H                 -1.92584300    4.00655200    0.41638300
 C                  0.46339500    5.85494900    2.01772900
 H                  2.17490000    5.00708000    3.01616900
 H                 -1.33491300    6.35331500    0.93654400
 C                  0.80728500    7.28712400    2.35370800
 H                  0.53941500    7.96488900    1.53579000
 H                  0.26106700    7.62409000    3.24469900
 H                  1.87580000    7.40580300    2.56092400
 C                  0.60647500    0.50478800   -6.59678100
 H                 -0.22010900    1.06371800   -7.05532800
 H                  1.53323100    1.02639500   -6.86022800
 H                  0.62813800   -0.48646800   -7.06139700
 C                 -1.79708200    3.90573000   -2.53038500
 H                 -2.65308300    4.42144800   -2.97724600
 H                 -1.22300600    4.63813100   -1.94246000
 H                 -1.15472400    3.53071000   -3.33990000
 O                 -2.30602800    2.85358400   -1.72035700
 H                 -1.53986600    2.40711200   -1.30306100


