%nprocshared=12
%mem=20000MB
%chk=AlMe.chk
#p opt freq wb97xd/6-311g(d,p) scrf=(smd,solvent=toluene) 

Al-Methyl catalyst

0 1
 Al                -0.65954300   -1.22612400    0.18903500
 N                 -0.66510800    0.12312700   -1.25928400
 O                 -0.11221700   -0.24724800    1.56221000
 O                  0.53386700   -2.39264200   -0.40905100
 O                 -2.33595300   -1.76826000    0.25570800
 C                 -0.51172100    1.50185600   -0.65807500
 C                  0.44993000   -0.19027700   -2.23941000
 C                 -2.00439300    0.02000700   -1.96596400
 C                  0.80405100    0.74414300    1.36256900
 C                  1.72277100   -1.79681000   -0.74855000
 C                 -3.31503400   -0.84312900    0.02234600
 H                 -1.44152000    1.68996700   -0.10759800
 H                 -0.44801900    2.22587300   -1.47920200
 C                  0.67413100    1.62733600    0.26407200
 H                  0.62948900    0.70132400   -2.85025400
 H                  0.05721800   -0.97864500   -2.89185700
 C                  1.73405600   -0.66802400   -1.60043400
 H                 -1.99555700   -0.94898600   -2.47950700
 H                 -2.05840900    0.81040900   -2.72374100
 C                 -3.18579300    0.09349300   -1.02968900
 C                  1.89594600    0.87480000    2.24566000
 C                  2.93102400   -2.29285000   -0.21101300
 C                 -4.46028500   -0.82586200    0.85042400
 C                  1.63759700    2.61909800    0.05420900
 C                  2.95011000   -0.03314500   -1.88703200
 C                 -4.19017900    1.05387400   -1.22574000
 C                  2.83812100    1.88612400    2.00132100
 C                  4.12387400   -1.62979100   -0.52636100
 C                 -5.44561800    0.13899100    0.60789200
 C                  2.73562400    2.76713700    0.91434400
 H                  1.53279900    3.27964000   -0.80682500
 C                  4.15968500   -0.49467300   -1.35494000
 H                  2.94340100    0.84744200   -2.52847500
 C                 -5.33304000    1.09385500   -0.41855900
 H                 -4.07080800    1.77710400   -2.03213800
 H                  3.68817400    1.97614600    2.67813900
 H                  5.05400000   -2.00261000   -0.09600200
 H                 -6.32594100    0.15394100    1.25157600
 C                  2.90634300   -3.48372900    0.71159300
 H                  2.25114500   -3.30008600    1.57351200
 H                  2.51381300   -4.37657000    0.20587100
 H                  3.91211100   -3.71143800    1.08148600
 C                  2.04638800   -0.07987400    3.40141300
 H                  1.16185300   -0.06580200    4.05218100
 H                  2.15907400   -1.11435500    3.04878100
 H                  2.92459000    0.17360700    4.00603500
 C                  5.45760700    0.23365100   -1.61422800
 H                  5.76755300    0.80971900   -0.72995100
 H                  6.27297300   -0.46355000   -1.84703800
 H                  5.35971500    0.93787700   -2.44869600
 C                  3.78387100    3.82445200    0.65547400
 H                  3.33914000    4.82722700    0.59368200
 H                  4.53790200    3.83736800    1.45089800
 H                  4.30456500    3.64530900   -0.29616200
 C                 -4.58509500   -1.82001400    1.97569200
 H                 -4.55387100   -2.85290700    1.60339700
 H                 -3.75329400   -1.71956700    2.68644400
 H                 -5.52497700   -1.67698500    2.52020600
 C                 -6.41636400    2.12535400   -0.63430800
 H                 -7.37577700    1.65066000   -0.88351000
 H                 -6.58133400    2.72641400    0.27059900
 H                 -6.15741900    2.80842600   -1.45146200

