%chk=Before.chk
%nprocshared=8
%mem=30GB
#p opt=(tight,noeigentest) iop(1/8=1) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 1.47767300   11.87051900    2.18796900
 N                  1.17219500   12.63650100    0.19789300
 O                  3.18024700   11.50304500    1.78713900
 O                  0.33529500   10.50073900    1.82916900
 O                  0.97474600   13.42845700    2.87979300
 C                  2.42081600   13.29685500   -0.27009500
 H                  2.65951900   14.08305400    0.45372800
 H                  2.22264400   13.78952400   -1.23239500
 C                  3.58858800   12.36027600   -0.39968900
 C                  3.92657000   11.53198400    0.68407400
 C                  5.08703300   10.73397600    0.60463200
 C                  5.84675000   10.76471000   -0.56386900
 H                  6.74345900   10.14731300   -0.61439400
 C                  5.50503000   11.55443300   -1.66477500
 C                  4.36601600   12.35084100   -1.55690400
 H                  4.07578500   12.99095600   -2.38850100
 C                  0.83094300   11.52898100   -0.73544800
 H                  1.64863400   10.80280500   -0.68701300
 H                  0.79842500   11.92349500   -1.76030400
 C                 -0.46865800   10.86375100   -0.39140700
 C                 -0.64928100   10.38735500    0.91342600
 C                 -1.86007700    9.77177500    1.27335800
 C                 -2.84902900    9.62521800    0.29951400
 H                 -3.78591000    9.14810100    0.57668100
 C                 -2.68305300   10.07925900   -1.01369000
 C                 -1.48363800   10.70998900   -1.33592200
 H                 -1.32760500   11.09738700   -2.33868500
 C                  0.06452600   13.63304800    0.20519100
 H                 -0.82599800   13.12171000    0.58484500
 H                 -0.14757100   13.93561300   -0.82973400
 C                  0.36464300   14.83773900    1.04956700
 C                  0.80555000   14.64901000    2.36759900
 C                  1.07879800   15.77235000    3.17461900
 C                  0.89517500   17.04505100    2.64074300
 H                  1.11246600   17.90906600    3.26781200
 C                  0.45596400   17.25317400    1.32813900
 C                  0.20319800   16.12896200    0.54566300
 H                 -0.12697100   16.25296200   -0.48449900
 C                 -2.07298600    9.31126500    2.68907500
 H                 -3.07286600    8.88862600    2.81504700
 H                 -1.33950500    8.55018000    2.98601200
 H                 -1.95204600   10.13961800    3.39660300
 C                  1.57698400   15.56450600    4.57833700
 H                  2.52353700   15.01081600    4.58384300
 H                  1.73598000   16.52163000    5.08496900
 H                  0.86870000   14.97447900    5.17126700
 C                  0.25842000   18.64923300    0.79121500
 H                 -0.62500900   19.12765400    1.23273700
 H                  1.11746400   19.29146800    1.01740000
 H                  0.11991900   18.64201200   -0.29488800
 C                 -3.77756600    9.89586400   -2.03559600
 H                 -3.95909300    8.83386500   -2.24116800
 H                 -4.72559800   10.32186100   -1.68655200
 H                 -3.52203700   10.37971800   -2.98363700
 C                  5.51142500    9.87544500    1.76971500
 H                  6.58330500    9.99379400    1.97089300
 H                  4.95456100   10.13728800    2.66790900
 H                  5.34684900    8.80954700    1.56510900
 C                  6.34542400   11.54237300   -2.91799700
 H                  6.30510200   10.56715700   -3.41891300
 H                  6.00146300   12.29556100   -3.63424400
 H                  7.39962100   11.74689400   -2.69709200
 O                  0.95033500    9.15597900    4.40245900
 H                  0.80118800    8.73516000    2.20983600
 C                  1.82658700    9.98905600    4.22113100
 O                  3.15683300    9.55514500    4.27714200
 O                  1.73453200   11.22547500    3.95610600
 C                  3.22779100    8.16644200    4.31586200
 C                  2.81596400    7.47035500    3.08621500
 H                  2.82245600    7.71672400    5.22553100
 O                  1.19142300    7.85725400    1.95003200
 C                  2.61039600    8.08381500    1.76733200
 H                  2.72174300    6.38325500    3.14660500
 H                  2.99586300    7.51350200    0.91568000
 H                  2.85767800    9.14345100    1.70278900
 H                  4.30962600    7.87774900    4.28161300 
 






