%chk=Before-CHO.chk
%nprocshared=8
%mem=22GB
#p opt=(noeigentest) iop(1/8=10) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 2.07479700   10.71755400    1.75269200
 N                  1.41225200   11.95200100    0.27639000
 O                  3.85111000   10.88038800    1.44552400
 O                  1.78842800    9.18732400    0.82956700
 O                  2.23343500   12.39779100    2.85365600
 C                  2.52934700   12.85808800   -0.14587700
 H                  2.76849000   13.50246900    0.70138700
 H                  2.16016700   13.49821200   -0.95364400
 C                  3.76200400   12.11636400   -0.59894500
 C                  4.36220600   11.16559700    0.23611100
 C                  5.52638200   10.49941700   -0.17999000
 C                  6.06709400   10.80719500   -1.42178700
 H                  6.96822400   10.28904700   -1.74104100
 C                  5.48630200   11.74950700   -2.27522200
 C                  4.32890100   12.38778600   -1.84483500
 H                  3.84724800   13.11797400   -2.48978700
 C                  0.98307400   11.15789300   -0.92483000
 H                  1.89926400   10.78841800   -1.38843700
 H                  0.50119200   11.84197900   -1.63048400
 C                  0.09511200    9.98931700   -0.61226600
 C                  0.60075000    9.00492600    0.24715100
 C                 -0.15312200    7.84527700    0.49523100
 C                 -1.39139800    7.71051400   -0.12323800
 H                 -1.97460600    6.81355200    0.07346700
 C                 -1.91860300    8.68752200   -0.97352300
 C                 -1.15567700    9.82824100   -1.20395700
 H                 -1.53206100   10.60597300   -1.86399200
 C                  0.24514400   12.75348000    0.73144500
 H                 -0.55230000   12.04178100    0.95830300
 H                 -0.09372200   13.36648700   -0.11068900
 C                  0.44081100   13.66144200    1.92664100
 C                  1.35903700   13.45710900    2.95086900
 C                  1.41288300   14.28911500    4.07386300
 C                  0.52723300   15.35710100    4.13671300
 H                  0.56104700   16.01001800    5.00432600
 C                 -0.40441700   15.60627600    3.12808400
 C                 -0.42732400   14.75006100    2.03575900
 H                 -1.14408100   14.92307800    1.23812800
 O                  4.37403900   10.23292200    5.58767900
 C                  3.12104000   10.03483100    6.26262600
 C                  3.67119000    9.00059900    5.39527700
 H                  3.00775373   11.04544356    5.88491342
 C                  0.38048200    6.81222800    1.44692000
 H                  1.41747200    6.55637000    1.21411400
 H                  0.37081000    7.18792000    2.47590200
 H                 -0.21992600    5.89997800    1.41739400
 C                  2.39692500   14.02246300    5.17985700
 H                  2.32344400   12.98993600    5.53586200
 H                  3.42813600   14.18172000    4.85218700
 H                  2.20696900   14.68606800    6.02449100
 C                 -1.36213800   16.76303800    3.23702700
 H                 -2.09562700   16.58942500    4.03071600
 H                 -0.83577400   17.69091200    3.47749800
 H                 -1.90801900   16.91323000    2.30323800
 C                 -3.26431600    8.49479700   -1.62582200
 H                 -3.22824100    7.71315200   -2.39211600
 H                 -4.02173800    8.19583200   -0.89528500
 H                 -3.60575400    9.41439100   -2.10719700
 C                  6.14201300    9.47605100    0.73155800
 H                  6.43809700    9.92248000    1.68634400
 H                  5.42690100    8.68084600    0.96294200
 H                  7.02654100    9.02603400    0.27589100
 C                  6.10788200   12.05915200   -3.61261500
 H                  7.06880800   12.57046600   -3.49344600
 H                  6.29647900   11.14498400   -4.18318800
 H                  5.46023600   12.70307600   -4.21223200
 H                  4.16147500    8.14543900    5.85384500
 C                  3.14450200    8.70564100    4.01937400
 H                  3.96601500    8.59736400    3.30976600
 O                  2.32508700    9.75614400    3.50372400
 C                  0.90127500    9.73398800    3.69145400
 O                  0.40260000    9.08307800    4.56414500
 O                  0.44097000   10.49351300    2.78499300
 H                  4.60815600   11.53914200    4.37973200
 O                  4.64408400   12.18838300    3.65372500
 H                  4.71167500   11.64464400    2.84676400
 H                  3.13777800   12.51015000    3.28794300
 C                  2.48539931    7.43159508    4.57972267
 H                  3.10997373    6.58728493    4.37491261
 H                  1.53134476    7.29024344    4.11636574
 C                  2.31965031    9.07744811    7.16417609
 C                  2.30050187    7.57616573    6.10173195
 H                  3.05441573    6.94381915    6.52203150
 H                  1.35072415    7.12414056    6.29793472
 H                  2.83203068    8.89329325    8.08529137
 H                  1.32889138    9.44410052    7.33406647 
 






