%chk=Guess-CHO.chk
%nprocshared=16
%mem=60GB
#p opt=(modredundant,noeigentest) iop(1/8=1) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 1.88051800   12.44210600    2.04505700
 N                  0.78762700   13.72233000    0.73385700
 O                  3.34901700   12.68567000    1.05339000
 O                  0.82016000   11.03338400    1.58412600
 O                  1.47959800   13.51000600    3.41675200
 C                  1.67548300   14.82144900    0.26301300
 H                  2.05216400   15.33567400    1.15160300
 H                  1.07246600   15.54235700   -0.30269700
 C                  2.82175200   14.34022900   -0.57635500
 C                  3.60892000   13.28238900   -0.10553500
 C                  4.69901800   12.83691200   -0.87898600
 C                  4.96623100   13.46425500   -2.09011900
 H                  5.80807000   13.11341000   -2.68318600
 C                  4.18854000   14.51953100   -2.57625400
 C                  3.11282500   14.93748900   -1.80128000
 H                  2.47816000   15.74721300   -2.15253400
 C                  0.31100000   12.94148900   -0.43971800
 H                  1.18630000   12.47748700   -0.90084400
 H                 -0.12305300   13.63034500   -1.17458200
 C                 -0.69179100   11.89522900   -0.05563300
 C                 -0.38223900   10.99701300    0.97114600
 C                 -1.34686700   10.06074100    1.38146000
 C                 -2.57166200   10.02518900    0.72309600
 H                 -3.31256800    9.29931600    1.04967400
 C                 -2.88805500   10.89291400   -0.32262700
 C                 -1.93236400   11.83413900   -0.68676300
 H                 -2.15345700   12.54952500   -1.47437100
 C                 -0.37992900   14.31798600    1.44082900
 H                 -0.99823500   13.49085500    1.79929000
 H                 -0.97934300   14.88688400    0.71953100
 C                  0.00762200   15.19525400    2.59602400
 C                  0.91843600   14.70878900    3.54116000
 C                  1.25396600   15.50547400    4.65328800
 C                  0.66917900   16.75904800    4.78395700
 H                  0.93361800   17.36927200    5.64487100
 C                 -0.23663400   17.26453100    3.84614000
 C                 -0.54998000   16.46334500    2.75396200
 H                 -1.24704400   16.82645900    2.00267500
 C                 -1.05466700    9.12976300    2.52190800
 H                 -1.97878700    8.73561100    2.95028800
 H                 -0.45560100    8.27471200    2.19284000
 H                 -0.49112300    9.63914100    3.30544900
 C                  2.23729500   14.97584000    5.65813800
 H                  3.19605100   14.74456800    5.18403600
 H                  2.41136400   15.70125400    6.45634200
 H                  1.87993300   14.04418000    6.10739400
 C                 -0.83629000   18.63720200    4.01676800
 H                 -1.35454900   18.73102500    4.97627600
 H                 -0.06553900   19.41443800    3.99006500
 H                 -1.55694100   18.85534400    3.22495500
 C                 -4.22731300   10.81667600   -1.00906100
 H                 -4.37476100    9.84148200   -1.48377700
 H                 -5.04653900   10.95761700   -0.29715000
 H                 -4.31921700   11.58217800   -1.78292100
 C                  5.53242200   11.69199100   -0.37731400
 H                  6.33910000   11.45917500   -1.07625800
 H                  5.97366500   11.91999100    0.59757800
 H                  4.92441900   10.79201900   -0.24029700
 C                  4.51240600   15.17145100   -3.89629900
 H                  4.57638200   14.43187700   -4.70038100
 H                  3.74948400   15.90276000   -4.17341400
 H                  5.47486100   15.69226700   -3.85837600
 O                  1.65226800   10.38935100    4.80185300
 H                  1.70153000    8.23013500    3.54204000
 C                  2.68748100   10.61964500    4.17331600
 O                  3.76051500    9.90772900    4.59181600
 O                  2.92240500   11.34379500    3.17509500
 C                  3.39373800    9.12086500    5.72095100
 C                  1.90820100    8.70166200    5.63760900
 H                  3.44931000    9.75022800    6.61493500
 O                  1.20648000    8.13141200    4.40527700
 C                  1.68771400    7.21555800    5.47117600
 H                  1.21991000    9.13219600    6.34364600
 H                  0.81005000    6.78277100    5.93844100
 O                  2.11455500    8.66104300    2.10756300
 H                  3.04126500    8.88066300    1.96933500
 H                  1.62121400    9.48821100    1.89322000
 C                  4.37775100    7.96963100    5.81701500
 C                  2.75558300    6.23836300    5.08117500
 C                  4.09204200    6.90715100    4.76347900
 H                  5.38595600    8.37728200    5.72046700
 H                  4.29792000    7.52943500    6.81624500
 H                  4.08057000    7.36269100    3.76801700
 H                  4.88055800    6.15300700    4.75042300
 H                  2.87864500    5.57919600    5.94684600
 H                  2.39671600    5.61097300    4.25944900
 
 B 63 69 F
 
 
