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

Dimer

0 1
 Al                 1.96103200   10.31169700    1.95298900
 N                  1.96622100   11.85318600    0.44327100
 O                  3.65770400   10.77441400    2.34473200
 O                  1.23559800    9.23436000    0.71604000
 O                  0.69939900   11.22862900    2.88909000
 C                  2.77843700   13.02621300    0.85243000
 H                  2.34172600   13.41209500    1.77825600
 H                  2.67443800   13.81358900    0.09159800
 C                  4.22957400   12.71420500    1.07730300
 C                  4.57746000   11.59416500    1.84811400
 C                  5.93930100   11.34234400    2.12237600
 C                  6.90127100   12.22173400    1.63350900
 H                  7.94936600   12.02450400    1.85733600
 C                  6.57189900   13.34203900    0.86209100
 C                  5.22371400   13.56346500    0.59000400
 H                  4.93073900   14.42394100   -0.01012100
 C                  2.52983400   11.28919500   -0.81133600
 H                  3.52940100   10.91127000   -0.56777100
 H                  2.66306800   12.10310200   -1.53885400
 C                  1.69993600   10.19370600   -1.42334900
 C                  1.13124900    9.20571500   -0.60304900
 C                  0.39938800    8.15425900   -1.20034400
 C                  0.25971000    8.12364600   -2.58328600
 H                 -0.30454300    7.30728000   -3.03330300
 C                  0.81239000    9.10577700   -3.41512000
 C                  1.52602500   10.13544700   -2.80812200
 H                  1.96415700   10.91979900   -3.42414100
 C                  0.56595600   12.28882000    0.21745000
 H                 -0.01739300   11.40022900   -0.03770400
 H                  0.53510400   12.96118200   -0.65157300
 C                 -0.03503900   12.97563100    1.41197900
 C                  0.06133600   12.39848800    2.68937500
 C                 -0.51937900   13.07096800    3.78593700
 C                 -1.17964500   14.27833100    3.56952800
 H                 -1.62359500   14.78294600    4.42661100
 C                 -1.28303100   14.86663200    2.30714500
 C                 -0.68915400   14.19707000    1.24182200
 H                 -0.73317600   14.63040300    0.24399100
 O                  2.10478300    8.85661000    3.12750100
 C                  2.21279200    9.99214400    5.25002000
 C                  1.80637300    8.72664900    4.48574600
 H                  3.03640700   10.48808200    4.73311400
 H                  1.38275900   10.68477500    5.33440000
 C                 -0.20417700    7.09834600   -0.31570000
 H                  0.56378800    6.60577300    0.29191000
 H                 -0.92513800    7.53121000    0.38836100
 H                 -0.71928600    6.33478500   -0.90771200
 C                 -0.40470500   12.52058100    5.18006000
 H                 -0.65534500   11.45693900    5.22983800
 H                  0.61928400   12.63354600    5.55672100
 H                 -1.06798200   13.06043100    5.86236700
 C                 -2.00723500   16.17575400    2.11860400
 H                 -3.08713000   16.05999600    2.27364900
 H                 -1.65948700   16.93140200    2.83251800
 H                 -1.85795400   16.57243200    1.10921100
 C                  0.63199900    9.04063800   -4.91176700
 H                  1.10200000    8.14485500   -5.33651400
 H                 -0.42906300    9.00645100   -5.18775700
 H                  1.07632100    9.91234900   -5.40334000
 C                  6.31777200   10.12524000    2.92161200
 H                  7.31852500   10.22943600    3.35387900
 H                  5.59965200    9.94284000    3.72586500
 H                  6.31499400    9.22493300    2.29416900
 C                  7.64581200   14.26596400    0.34230100
 H                  8.27425700   14.64907000    1.15527500
 H                  8.31185500   13.75329800   -0.36277500
 H                  7.21178500   15.12632000   -0.17734500
 H                  2.40099500    7.89092900    4.87639300
 C                  0.36063600    8.30209200    4.70977800
 H                  0.21243500    7.36302500    4.15581000
 H                  0.23099000    8.08198200    5.77623800
 O                 -0.62231500    9.24330300    4.33523800
 H                 -0.21739700    9.90164900    3.73769000
 O                  2.64109100    9.70417700    6.61940200
 C                  3.96191300    9.12429700    6.65589100
 H                  4.01008500    8.50795100    7.55532900
 H                  4.07784900    8.46866000    5.79064300
 Al                 2.02135100   11.13809700    7.90874500
 O                  3.21532900   10.37839100    9.20746000
 O                  2.88095100   12.26678800    6.88000600
 O                  0.39037600   10.52258700    7.76298200
 C                  3.24171700   10.44553400   10.61852900
 C                  3.01804000   13.60393600    6.91795500
 C                 -0.79394300   11.01189500    8.18664200
 C                  2.34155700   11.26716600   11.28533300
 C                  4.19670400    9.67489700   11.28614500
 C                  2.87879100   14.31481700    8.11490800
 C                  3.29804600   14.27969300    5.71858400
 C                 -0.91385500   12.30883400    8.70495200
 C                 -1.93069200   10.18520900    8.11861800
 C                  1.20826100   11.99547800   10.61409700
 C                  2.43466100   11.33637500   12.67756600
 C                  4.24412900    9.77496800   12.67427500
 C                  5.14808000    8.77220400   10.54782800
 C                  2.60397300   13.57790900    9.39792900
 C                  3.00753200   15.70483200    8.10775000
 C                  3.43379100   15.66471000    5.75428500
 C                  3.44881700   13.49631600    4.44482200
 C                  0.27583200   13.22536000    8.75264400
 C                 -2.15360900   12.76917600    9.15300400
 C                 -3.15033000   10.68255800    8.56916300
 C                 -1.82136500    8.80558200    7.53444400
 N                  1.51105000   12.56386200    9.27653500
 H                  0.36965000   11.30320500   10.49621500
 H                  0.86243500   12.80702800   11.26600100
 C                  3.37856000   10.60408400   13.39039200
 H                  1.74120000   11.98190100   13.21076300
 H                  4.98243900    9.18356600   13.21080600
 H                  4.63930100    8.19039100    9.77202900
 H                  5.95540400    9.34131900   10.07373900
 H                  5.61165000    8.06714200   11.24213600
 H                  3.50174700   13.04867900    9.73586900
 H                  2.32719100   14.28634300   10.18756400
 C                  3.29500200   16.40090800    6.93627500
 H                  2.88080600   16.24918500    9.04168000
 H                  3.65003200   16.19001500    4.82525300
 H                  4.23251600   12.73619000    4.53472000
 H                  2.53013700   12.95939200    4.18130700
 H                  3.71334000   14.15605800    3.61354400
 H                  0.50771200   13.59951900    7.75065800
 H                  0.05723700   14.09742800    9.38086300
 C                 -3.29211400   11.97251000    9.09012100
 H                 -2.22123500   13.77568900    9.56154600
 H                 -4.02477100   10.03584300    8.51458600
 H                 -1.66032800    8.86878600    6.45275100
 H                 -0.97624200    8.25518500    7.96094700
 H                 -2.73635900    8.23260700    7.71420500
 C                  3.47049400   10.69340400   14.89116100
 C                  3.46655400   17.89923900    6.93469700
 C                 -4.63244100   12.46962300    9.57069300
 H                  3.31855400    9.71147500   15.35329700
 H                  4.45918900   11.04877400   15.20308500
 H                  2.72087000   11.37942200   15.29601400
 H                  4.52326300   18.17797200    6.83641800
 H                  2.93248600   18.36238900    6.09750400
 H                  3.09252700   18.34410000    7.86228600
 H                 -5.36351800   12.50070100    8.75389300
 H                 -5.04599800   11.81421200   10.34628800
 H                 -4.55509000   13.47792500    9.98961500
 C                  5.05989800   10.14912300    6.62912100
 C                  6.31542200    9.84032300    7.30791200
 O                  5.37892200   10.76473500    7.89957800
 H                  5.06075500   10.85868300    5.80729900
 H                  6.42203200    8.89365100    7.83223700
 H                  7.23309200   10.31142700    6.96993000
 H                  4.16062200   10.42336000    8.84411600
 C                  3.74715400    7.84730200    2.61176300
 O                  3.76456300    7.94896800    1.43452400
 O                  4.16308800    7.44510800    3.64892700
 
 B 39 147 S 5 -0.07
 






