%chk=Scan-CC2.chk
%nprocshared=12
%mem=20GB
#p opt=(modredundant,noeigentest) iop(1/8=10) wb97xd/6-31G* nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 2.88215600   10.44965200    1.46034400
 N                  2.05424200   11.76478500    0.07736000
 O                  4.46103000   10.51242900    0.66783700
 O                  1.57357100    9.29029500    1.19916200
 O                  2.65819400   11.93109200    2.75731100
 C                  3.07281800   12.74913800   -0.39904300
 H                  3.42173300   13.30909900    0.47221400
 H                  2.57882800   13.46065000   -1.06973900
 C                  4.24479500   12.11089000   -1.09035200
 C                  4.89088400   11.02623500   -0.48903100
 C                  6.01792100   10.45488900   -1.10571300
 C                  6.46769400   10.99198200   -2.30559400
 H                  7.34079800   10.54874100   -2.77870000
 C                  5.83500300   12.07339500   -2.92586800
 C                  4.71790000   12.61559200   -2.30116200
 H                  4.19935200   13.45387400   -2.75926800
 C                  1.59670800   10.94847700   -1.09132300
 H                  2.45674500   10.36922700   -1.43852200
 H                  1.31596700   11.63347700   -1.89843500
 C                  0.45136600   10.03530800   -0.76621700
 C                  0.52255300    9.23368400    0.37692300
 C                 -0.53695100    8.36059500    0.68261200
 C                 -1.63208500    8.31483800   -0.17214600
 H                 -2.45068700    7.64048200    0.06850100
 C                 -1.72213300    9.10804700   -1.31988000
 C                 -0.66761000    9.97059400   -1.59460300
 H                 -0.70942700   10.61185500   -2.47117700
 C                  0.87791600   12.48958300    0.63127700
 H                  0.18961500   11.74552900    1.03969800
 H                  0.35993500   12.99420600   -0.19078000
 C                  1.22188400   13.49934300    1.68789200
 C                  2.09159900   13.20795600    2.72825900
 C                  2.42460400   14.14229900    3.70644600
 C                  1.80986700   15.38913700    3.63227400
 H                  2.05453500   16.12720000    4.39034500
 C                  0.91038200   15.72070500    2.62118100
 C                  0.64346000   14.76531200    1.64741700
 H                 -0.03205800   15.00198900    0.83144900
 O                  3.61329200   11.34675700    7.00067700
 C                  3.64578900    9.92416200    6.86151800
 C                  4.85217200   10.72402400    6.67565000
 H                  3.51708900    9.36680000    7.78534100
 H                  3.10783100    9.53595800    6.00152000
 C                 -0.46045700    7.51333300    1.92072500
 H                  0.36968600    6.80222900    1.86468900
 H                 -0.28515200    8.12852600    2.80807700
 H                 -1.38499600    6.94998600    2.06506500
 C                  3.43325700   13.83654400    4.77619100
 H                  3.18785200   12.93489300    5.34564400
 H                  4.42872900   13.70345200    4.34023400
 H                  3.49204800   14.66178600    5.48674800
 C                  0.24833500   17.07179800    2.59412300
 H                 -0.52726300   17.13588200    3.36391900
 H                  0.96928700   17.86968200    2.78949700
 H                 -0.22303500   17.26220200    1.62784100
 C                 -2.92547000    9.02280700   -2.22310700
 H                 -2.97976800    8.04995500   -2.72257400
 H                 -3.85630800    9.14915300   -1.66201800
 H                 -2.89281800    9.79282700   -2.99744600
 C                  6.69811900    9.28702000   -0.44997900
 H                  7.10527300    9.56376100    0.52752700
 H                  5.99154100    8.47096600   -0.27286600
 H                  7.51585000    8.91208300   -1.06936600
 C                  6.34560500   12.61384700   -4.23718900
 H                  7.41300400   12.84780800   -4.18179300
 H                  6.21626600   11.88500300   -5.04409900
 H                  5.81549900   13.52545600   -4.52285600
 H                  5.58648400   10.74452500    7.47903900
 C                  5.45177600   11.02611400    5.32850300
 H                  5.74644600   12.07464000    5.27612900
 H                  6.33282000   10.40247100    5.17607200
 O                  4.53277600   10.81850700    4.25503900
 C                  4.45521700    9.53647600    3.72742600
 O                  5.19355500    8.66251300    4.10452300
 O                  3.50813200    9.45823100    2.87273600
 H                  3.25643000   11.77058800    3.52397800
 
 B 74 41 S 6 -0.3





