%chk=Hemi-Carb.chk
%nprocshared=8
%mem=20GB
#p opt=(noeigentest) iop(1/8=1) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 2.02260200   11.04150700    1.90975800
 N                  1.55762100   12.26935100    0.26965800
 O                  4.00250600   11.39395700    1.54045200
 O                  2.11629500    9.57625000    0.85579000
 O                  1.90703000   12.44611700    3.00359000
 C                  2.69893900   13.16660900   -0.10575800
 H                  2.93933300   13.77557700    0.76682500
 H                  2.35519500   13.84105700   -0.89674900
 C                  3.92549500   12.43197100   -0.56882900
 C                  4.56317500   11.54328400    0.27988500
 C                  5.69305000   10.81950000   -0.08561100
 C                  6.19949100   11.04416400   -1.36185100
 H                  7.08322600   10.49399400   -1.67152200
 C                  5.60557300   11.94041000   -2.25173700
 C                  4.46168600   12.61842300   -1.84084800
 H                  3.96714200   13.30619100   -2.51970500
 C                  1.17330200   11.48073300   -0.93948000
 H                  2.10219100   11.21838200   -1.44875400
 H                  0.60483100   12.13008500   -1.61226100
 C                  0.43619900   10.19575000   -0.69398500
 C                  1.06024400    9.22439400    0.10723400
 C                  0.58761000    7.90336500    0.07642600
 C                 -0.56802400    7.62603600   -0.65464900
 H                 -0.94019000    6.60368700   -0.66185900
 C                 -1.25720700    8.59981100   -1.37452800
 C                 -0.71783600    9.88530200   -1.40182000
 H                 -1.18783600   10.65530400   -2.00838200
 C                  0.39978000   13.13566400    0.65388600
 H                 -0.41089900   12.46836300    0.95555900
 H                  0.08700300   13.69679200   -0.23373800
 C                  0.69767800   14.09620900    1.77222900
 C                  1.40872500   13.67535900    2.90270700
 C                  1.63014400   14.57812000    3.95999000
 C                  1.13488400   15.87209100    3.85841100
 H                  1.30985300   16.56356400    4.67969500
 C                  0.42659300   16.31380700    2.73767200
 C                  0.22546700   15.40615900    1.70389600
 H                 -0.31653500   15.71909200    0.81486100
 O                  2.96055300   10.01235000    3.38319900
 C                  2.56435900   10.18866300    4.77899600
 C                  2.12864200    9.01399900    4.03854900
 H                  3.40241900   10.11305800    5.46081500
 H                  1.86596500   11.00270400    4.92537200
 C                  1.33996300    6.79204500    0.76260800
 H                  1.73254000    6.08608800    0.02342700
 H                  2.18498100    7.18398400    1.32967100
 H                  0.69593600    6.22303600    1.43971500
 C                  2.38634200   14.10747700    5.16990900
 H                  1.84518600   13.30670100    5.68443700
 H                  3.36168500   13.69705500    4.89142100
 H                  2.54175400   14.92350800    5.87927800
 C                 -0.09558400   17.72590000    2.66175900
 H                 -0.82212800   17.92595900    3.45596300
 H                  0.71106600   18.45819100    2.76958000
 H                 -0.58957100   17.91187500    1.70508200
 C                 -2.53050400    8.26797500   -2.10932000
 H                 -2.45978000    7.29894000   -2.61123300
 H                 -3.38188300    8.21825900   -1.42198500
 H                 -2.76083000    9.02450300   -2.86341500
 C                  6.31752600    9.83284700    0.86244300
 H                  6.68835000   10.31748600    1.77314200
 H                  5.60283300    9.05748900    1.15836500
 H                  7.16714900    9.33731500    0.39184800
 C                  6.19641100   12.15880000   -3.61934200
 H                  7.17287300   12.64759400   -3.54779900
 H                  6.34423000   11.20858500   -4.13978900
 H                  5.55009100   12.78788100   -4.23477600
 H                  2.63487000    8.06738400    4.18891300
 C                  0.74208600    8.95401800    3.45568700
 H                  0.68474300    8.19182600    2.68388500
 H                  0.02502600    8.73597100    4.24510100
 O                  0.41806100   10.21013600    2.86129000
 H                  4.57008500   10.87975700    2.12896400
 C                 -0.63940600   11.00450800    3.54724000
 O                 -0.71463200   10.78845000    4.74613800
 O                 -1.23604700   11.70966800    2.75411000

 






