%chk=HCarb-Water.chk
%nprocshared=12
%mem=22GB
#p opt=(noeigentest) iop(1/8=1) freq=noraman bp86/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 1.86741800   10.83881500    1.87551700
 N                  1.22629600   11.89226800    0.25332300
 O                  3.62974100   10.92580300    1.52008300
 O                  0.99027700    9.32635700    1.49508900
 O                  1.35371200   12.02335700    3.09328900
 C                  2.29839700   12.86541600   -0.17103500
 H                  2.44603000   13.55798800    0.67461200
 H                  1.91703300   13.45810000   -1.02124200
 C                  3.60471100   12.20679600   -0.54108900
 C                  4.22817300   11.29767700    0.34438200
 C                  5.51377700   10.78346100    0.03772300
 C                  6.12368700   11.16954100   -1.16539700
 H                  7.11663000   10.76650400   -1.39470500
 C                  5.51002300   12.04681100   -2.08074300
 C                  4.24714600   12.55462500   -1.74395600
 H                  3.74335300   13.24976800   -2.42439600
 C                  0.93326300   10.95582800   -0.89196100
 H                  1.89399100   10.47537500   -1.14690000
 H                  0.62434400   11.55931100   -1.76403300
 C                 -0.10442000    9.90629200   -0.58631400
 C                  0.00944400    9.10930700    0.57823000
 C                 -0.90568700    8.04234300    0.78611000
 C                 -1.91490100    7.82342900   -0.16442600
 H                 -2.61578200    6.99762800    0.00477300
 C                 -2.06322200    8.62122900   -1.31559400
 C                 -1.14147300    9.66120600   -1.50457600
 H                 -1.21664900   10.29697500   -2.39371400
 C                 -0.03026800   12.64697500    0.63060900
 H                 -0.77135200   11.88284400    0.92394800
 H                 -0.41656600   13.15156600   -0.27276500
 C                  0.18034900   13.64991200    1.73900200
 C                  0.86391100   13.27207300    2.91989500
 C                  1.05349300   14.22387800    3.95816000
 C                  0.52637100   15.51274000    3.79592500
 H                  0.67752700   16.24092400    4.60140700
 C                 -0.17415600   15.90678000    2.63683200
 C                 -0.32532600   14.95748900    1.61556100
 H                 -0.84859100   15.23313600    0.69309200
 O                  5.16274600    9.94459700    5.40099500
 C                  4.07054300    9.40870200    6.19861700
 C                  4.49033100    8.72662000    4.96142000
 H                  4.36843100    8.98790000    7.16505800
 H                  3.16774900   10.02755600    6.20776400
 C                 -0.78987100    7.16629400    2.00912700
 H                  0.25096600    6.85365400    2.18558300
 H                 -1.12131900    7.69468300    2.91987300
 H                 -1.41351600    6.26541400    1.90357400
 C                  1.82942300   13.82915000    5.19012700
 H                  1.33310500   13.00796600    5.73545300
 H                  2.83434800   13.45993200    4.91942600
 H                  1.93817900   14.68310700    5.87638600
 C                 -0.72068300   17.31149500    2.49798900
 H                 -1.41441700   17.56135000    3.31930300
 H                  0.08567800   18.06552200    2.52076900
 H                 -1.26634200   17.43535300    1.54956900
 C                 -3.16706000    8.35042900   -2.31448900
 H                 -3.01786300    7.38718300   -2.83380600
 H                 -4.15420300    8.29892300   -1.82464800
 H                 -3.21145400    9.13772600   -3.08283600
 C                  6.21220900    9.86049100    1.00496200
 H                  6.26424400   10.31434200    2.00905600
 H                  5.68149800    8.89811300    1.10862300
 H                  7.23797200    9.64595700    0.66914400
 C                  6.19699800   12.42791500   -3.37387000
 H                  7.14713700   12.95812100   -3.18734900
 H                  6.44070400   11.53827800   -3.97975100
 H                  5.56097600   13.08651500   -3.98537900
 H                  5.11990100    7.83390900    5.05905300
 C                  3.73661900    8.76916600    3.65189000
 H                  4.31106400    9.28779500    2.87682200
 H                  3.50482200    7.74804700    3.32105600
 O                  2.47472700    9.53291700    3.71727700
 C                  1.47762100    8.84489700    4.38420300
 O                  1.57250000    7.70254900    4.77303500
 O                  0.43209900    9.66471000    4.54841100
 H                  5.07708500   11.52793800    4.35023200
 O                  5.07635100   12.27948000    3.71778500
 H                  4.53802100   11.92829900    2.97811100
 H                 -0.26501100    9.13186300    4.98804000 
 






