%chk=Scan-Ins-CC.chk
%nprocshared=12
%mem=20GB
#p opt=(modredundant,noeigentest) iop(1/8=10) wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 2.07019500   10.63222800    1.97832300
 N                  1.38791700   11.78692300    0.35137100
 O                  3.78858000   10.77244600    1.41256400
 O                  1.10351800    9.24662900    1.42473000
 O                  1.74953200   12.02585900    3.08792700
 C                  2.42174200   12.79468200   -0.01157100
 H                  2.63213000   13.38436000    0.88417400
 H                  2.00714000   13.47429100   -0.76510700
 C                  3.68780300   12.16736500   -0.52192300
 C                  4.30892700   11.17122500    0.23507600
 C                  5.49803600   10.57964800   -0.21737900
 C                  6.03541000   11.00614000   -1.42687100
 H                  6.95444700   10.54497700   -1.78051400
 C                  5.43009600   11.99607900   -2.20501400
 C                  4.24970500   12.56131200   -1.73443300
 H                  3.74675000   13.32558000   -2.32104200
 C                  1.11490000   10.92700400   -0.83475700
 H                  2.05023500   10.42114500   -1.08719000
 H                  0.84950700   11.57188700   -1.68119400
 C                  0.04175700    9.90591600   -0.60019600
 C                  0.12161500    9.09464500    0.53649600
 C                 -0.84524800    8.09297400    0.74432400
 C                 -1.86106800    7.93920600   -0.19219000
 H                 -2.60785600    7.16551900   -0.02790100
 C                 -1.96229200    8.74644600   -1.32948000
 C                 -0.99757800    9.73058000   -1.51200500
 H                 -1.04725800   10.37998000   -2.38245400
 C                  0.13056900   12.47833000    0.74042000
 H                 -0.58615500   11.70360000    1.03002900
 H                 -0.28088500   12.98154000   -0.14281300
 C                  0.27905000   13.46759300    1.86288300
 C                  1.03653500   13.15673500    2.99837000
 C                  1.06551300   14.05937400    4.07876700
 C                  0.35611300   15.25004800    3.98309600
 H                  0.38267900   15.93982700    4.82338000
 C                 -0.38621500   15.58932400    2.84960200
 C                 -0.40695500   14.68031300    1.79935500
 H                 -0.97748900   14.90922200    0.90284900
 O                  5.17062000   10.45944900    5.44365900
 C                  3.86291000   10.21011600    6.04756400
 C                  4.22183800    9.11578000    5.17762000
 H                  3.93109100   10.07134100    7.11917300
 H                  3.10528800   10.91417100    5.71727200
 C                 -0.75038400    7.22601400    1.96772800
 H                  0.19836800    6.68016400    1.98958100
 H                 -0.77904300    7.83033700    2.87849400
 H                 -1.56565500    6.49933100    1.99675500
 C                  1.85293300   13.72024600    5.31413400
 H                  1.64332500   12.69978700    5.64511500
 H                  2.93227500   13.79966900    5.14303400
 H                  1.60618800   14.40439300    6.12870800
 C                 -1.14139500   16.89177900    2.78316000
 H                 -1.91887000   16.93832400    3.55227700
 H                 -0.47632400   17.74601400    2.94304100
 H                 -1.62486700   17.01959300    1.81180800
 C                 -3.08014000    8.54371000   -2.32050000
 H                 -2.99889300    7.57224300   -2.81908600
 H                 -4.05776900    8.57536300   -1.82999800
 H                 -3.06726400    9.31603700   -3.09316000
 C                  6.14888800    9.51022800    0.61354900
 H                  6.47337600    9.90442600    1.58278100
 H                  5.44994100    8.69420200    0.82022300
 H                  7.02386700    9.09794000    0.10703500
 C                  6.04769700   12.43189700   -3.50840300
 H                  6.99013000   12.96395000   -3.34188900
 H                  6.27083800   11.57307300   -4.14854200
 H                  5.38159800   13.09894900   -4.06027800
 H                  4.78390000    8.30318400    5.61982200
 C                  3.83601700    8.98642700    3.73199900
 H                  4.61058500    9.40433000    3.08833500
 H                  3.77613700    7.91764200    3.50794400
 O                  2.61856200    9.62627800    3.50826300
 C                  1.47448300    8.99246300    4.65219400
 O                  2.12113000    8.26554100    5.36292200
 O                  0.40783600    9.46842800    4.44327900
 H                  4.99220600   11.13675100    4.68160900
 O                  4.52401400   12.10789800    3.64931100
 H                  4.55468300   11.67931600    2.77030600
 H                  3.56470500   12.26957600    3.73226700 
 
 B 73 72 S 5 0.044
 B 74 41 F





