%chk=TS-Ins-CC.chk
%nprocshared=12
%mem=22GB
#p opt=(ts,calcfc,noeigentest) iop(1/8=1) freq=noraman b3lyp/6-311G** EmpiricalDispersion=GD3 nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 2.05042500   10.68628400    1.91013700
 N                  1.38147600   11.83180600    0.29535800
 O                  3.79039800   10.79898400    1.43577100
 O                  1.20824700    9.23388100    1.33331000
 O                  1.73812400   12.04472700    3.05237100
 C                  2.45301700   12.81961500   -0.06997700
 H                  2.65018000   13.41848800    0.82453500
 H                  2.06117000   13.49621000   -0.83989400
 C                  3.71939500   12.15745600   -0.54891800
 C                  4.32758100   11.16911000    0.24253900
 C                  5.52368900   10.55515100   -0.17831700
 C                  6.08147500   10.94658000   -1.39752100
 H                  7.00315700   10.46907400   -1.72656800
 C                  5.49042000   11.92346300   -2.21316100
 C                  4.30265100   12.51220200   -1.77090900
 H                  3.81445500   13.26634800   -2.38522500
 C                  1.08306600   10.96276500   -0.89561500
 H                  2.02291500   10.47141600   -1.16509700
 H                  0.79656000   11.60925600   -1.73560500
 C                  0.02382100    9.92977400   -0.62890000
 C                  0.17072100    9.09034200    0.48969300
 C                 -0.77044800    8.06407100    0.72739200
 C                 -1.84086800    7.92101100   -0.15794200
 H                 -2.56929100    7.13240500    0.02755200
 C                 -2.01735200    8.75978600   -1.27062500
 C                 -1.07063700    9.76498200   -1.48515600
 H                 -1.17679200   10.43354400   -2.33781200
 C                  0.12767900   12.55643300    0.68554800
 H                 -0.60719800   11.78524400    0.94405500
 H                 -0.25925100   13.08039500   -0.19847900
 C                  0.27662000   13.52430700    1.83147300
 C                  1.02201300   13.18630900    2.97571400
 C                  1.03764500   14.06317900    4.08490500
 C                  0.32754300   15.26187500    4.00840400
 H                  0.34249900   15.93108100    4.86753700
 C                 -0.40183600   15.63165900    2.86837400
 C                 -0.40862300   14.74544400    1.78984300
 H                 -0.97067700   14.99777200    0.89232500
 O                  5.20435100   10.49187000    5.51835200
 C                  3.88911100   10.16053400    6.06232200
 C                  4.15984100    9.03113000    5.18670100
 H                  3.92965800    9.98546200    7.13449500
 H                  3.11342500   10.86407400    5.76638700
 C                 -0.59166900    7.16755900    1.92546200
 H                  0.37398800    6.64630400    1.88879800
 H                 -0.59081100    7.75000000    2.85370000
 H                 -1.38529800    6.41454500    1.97857200
 C                  1.81242200   13.68904900    5.32339200
 H                  1.61323300   12.65141200    5.61548000
 H                  2.89661000   13.78262800    5.17190700
 H                  1.54904600   14.34040100    6.16308700
 C                 -1.15443500   16.94113400    2.82403600
 H                 -1.92826100   16.98603400    3.60175800
 H                 -0.48673600   17.79638300    2.99123400
 H                 -1.64760700   17.08713300    1.85684800
 C                 -3.19378800    8.56943100   -2.20022000
 H                 -3.14998700    7.59961300   -2.71401300
 H                 -4.14678300    8.59753000   -1.65610400
 H                 -3.22554500    9.34906500   -2.96914500
 C                  6.16005500    9.50226000    0.69189200
 H                  6.45261500    9.91251900    1.66795800
 H                  5.46386900    8.67872400    0.89405800
 H                  7.05615500    9.08655400    0.22024600
 C                  6.12927800   12.32185100   -3.52309300
 H                  7.07117900   12.86374300   -3.36243500
 H                  6.36816000   11.44408200   -4.13667300
 H                  5.47091800   12.97197500   -4.10938800
 H                  4.75180200    8.21935600    5.59720100
 C                  3.79284900    8.95670100    3.74071000
 H                  4.56175300    9.39890100    3.10633700
 H                  3.70520100    7.90113000    3.46605700
 O                  2.57179700    9.64075400    3.52333800
 C                  1.45524700    9.10121400    4.46350600
 O                  1.93338600    8.29906300    5.27964500
 O                  0.37171300    9.59195100    4.22241900
 H                  5.01136500   11.16285300    4.75213600
 O                  4.49381500   12.14930700    3.68938500
 H                  4.53975200   11.71797900    2.80295400
 H                  3.52059100   12.27268700    3.76838700
 






