%chk=CarbH-Eq.chk
%nprocshared=12
%mem=22GB
#p opt=(noeigentest) iop(1/8=1) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 2.35886100   10.97288200    1.64869200
 N                  1.69170600   12.07624700    0.06530300
 O                  4.05652300   10.99263300    1.16202900
 O                  1.45254700    9.51547300    1.21487000
 O                  1.85278300   12.14766000    2.85681600
 C                  2.74038800   13.06835200   -0.30564900
 H                  2.91333400   13.69773900    0.57138300
 H                  2.34723800   13.71346600   -1.09926300
 C                  4.03379200   12.43975700   -0.74332000
 C                  4.63518500   11.44642100    0.04071600
 C                  5.87187600   10.90596400   -0.35444500
 C                  6.46750100   11.37197000   -1.52073300
 H                  7.42203800   10.94627300   -1.82108500
 C                  5.88114800   12.35498800   -2.32114100
 C                  4.65762800   12.87174400   -1.91273200
 H                  4.16842600   13.63427700   -2.51318400
 C                  1.41948300   11.18307900   -1.09432900
 H                  2.36396800   10.69444400   -1.34942100
 H                  1.12781200   11.80128100   -1.95102000
 C                  0.37111000   10.14236400   -0.82106800
 C                  0.46927500    9.33829000    0.32233700
 C                 -0.47188900    8.31377800    0.53096800
 C                 -1.48582600    8.13341000   -0.40357300
 H                 -2.21001300    7.33912500   -0.23767700
 C                 -1.61205100    8.93700600   -1.53900300
 C                 -0.66942100    9.94101800   -1.72592200
 H                 -0.73477300   10.58485300   -2.59909400
 C                  0.44013900   12.78618300    0.45834500
 H                 -0.28450000   12.01909200    0.74779900
 H                  0.03872700   13.29966300   -0.42257600
 C                  0.63692500   13.76352500    1.58378000
 C                  1.33036200   13.37014100    2.73540500
 C                  1.49621800   14.28375100    3.79286400
 C                  0.95606000   15.55781800    3.66987500
 H                  1.09075400   16.26120400    4.48842100
 C                  0.25798600   15.96941200    2.53057100
 C                  0.11585100   15.05387000    1.49504500
 H                 -0.40994600   15.34364100    0.58897300
 O                  5.04747100   11.42588100    4.77787100
 C                  4.20705900   10.80410900    5.74739800
 C                  4.96721400   10.00719100    4.78632700
 H                  4.55398300   10.86439800    6.77558100
 H                  3.14460700   10.97241500    5.59880100
 C                 -0.37196200    7.44527200    1.75387300
 H                  0.65962500    7.13365500    1.93516300
 H                 -0.70799100    7.98213900    2.64643500
 H                 -0.99312100    6.55296300    1.64977100
 C                  2.25120400   13.85229000    5.01806300
 H                  1.69340200   13.09232000    5.57519500
 H                  3.21007900   13.40167700    4.74879000
 H                  2.43140300   14.69802000    5.68571200
 C                 -0.30526300   17.36406800    2.43339800
 H                 -1.03116700   17.55781200    3.22950700
 H                  0.48238000   18.11910400    2.52278000
 H                 -0.80961600   17.51941300    1.47675800
 C                 -2.72752800    8.70824800   -2.52635300
 H                 -2.62254900    7.74031100   -3.02710900
 H                 -3.70350200    8.71297700   -2.03187100
 H                 -2.73700900    9.48246900   -3.29700300
 C                  6.51888000    9.84298900    0.48752200
 H                  6.77007800   10.22537200    1.48221100
 H                  5.84870100    8.98998600    0.63110100
 H                  7.43824600    9.48266600    0.02135100
 C                  6.56265100   12.83597800   -3.57588700
 H                  7.47216300   13.39946700   -3.34265000
 H                  6.85681900   11.99823300   -4.21528600
 H                  5.90750600   13.48852500   -4.15784700
 H                  5.87245500    9.50979100    5.12982600
 C                  4.36613600    9.34168400    3.58150700
 H                  4.87180600    9.65930100    2.67533700
 H                  4.41191900    8.25860600    3.67893700
 O                  2.98076700    9.73170000    3.37801400
 C                  2.07442000    9.01592100    4.09215500
 O                  2.30827200    7.97663100    4.63564800
 O                  0.92658700    9.66504600    4.10568700
 H                  0.27700100    9.11037800    4.55827100
 






