%chk=HCarb.chk
%nprocshared=12
%mem=22GB
#p opt=(noeigentest) iop(1/8=10) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

Dimer

0 1
 Al                 1.62833700   12.04742200    2.35489400
 N                  1.24261300   12.64586200    0.35319700
 O                  3.29544000   11.61042200    1.94457800
 O                  0.39881000   10.58710900    1.99863100
 O                  1.02688200   13.58102500    2.97714200
 C                  2.48228400   13.31509900   -0.15151700
 H                  2.72369500   14.12022200    0.54812600
 H                  2.25817900   13.77861900   -1.11873900
 C                  3.65187900   12.38171300   -0.27974300
 C                  4.00852600   11.58937000    0.81489300
 C                  5.13465100   10.75106800    0.73886200
 C                  5.86366100   10.72320600   -0.44417900
 H                  6.73512500   10.07518200   -0.50190300
 C                  5.51679200   11.49540400   -1.55689000
 C                  4.40241500   12.32055400   -1.45270900
 H                  4.10618400   12.93618300   -2.29796300
 C                  0.92267200   11.51490600   -0.56212000
 H                  1.74280300   10.79521000   -0.50467500
 H                  0.88650100   11.89405500   -1.58886700
 C                 -0.36729400   10.82247000   -0.23356600
 C                 -0.57826900   10.32833900    1.03961600
 C                 -1.71871400    9.62161200    1.40439900
 C                 -2.67772000    9.42506700    0.41575600
 H                 -3.57977100    8.87576800    0.66965800
 C                 -2.52201900    9.92012700   -0.88087400
 C                 -1.36052600   10.62203200   -1.18877800
 H                 -1.21476100   11.01865800   -2.18874900
 C                  0.11221800   13.62364600    0.31284000
 H                 -0.76789700   13.11976000    0.72181600
 H                 -0.10116300   13.86320900   -0.73491800
 C                  0.38391000   14.87926600    1.08717100
 C                  0.82276100   14.77521800    2.40982800
 C                  1.05738500   15.94014100    3.16095300
 C                  0.83829400   17.17502900    2.56164900
 H                  1.02224300   18.07506200    3.14365500
 C                  0.40202100   17.30145500    1.23962200
 C                  0.18357700   16.13467200    0.51614500
 H                 -0.14915100   16.19484600   -0.51688100
 C                 -1.87485400    9.08705200    2.79884800
 H                 -2.86276300    8.64544300    2.93459200
 H                 -1.12883200    8.31157300    3.00144300
 H                 -1.74354000    9.87565200    3.54575300
 C                  1.54304100   15.81786800    4.57703300
 H                  2.49856500   15.28609300    4.62028900
 H                  1.67430200   16.80177300    5.03268600
 H                  0.84018200   15.24456100    5.18874300
 C                  0.19852600   18.66137400    0.62227100
 H                 -0.43715800   19.29299200    1.25000200
 H                  1.15128900   19.18578300    0.49493600
 H                 -0.27136800   18.58152800   -0.36078500
 C                 -3.59531700    9.69786800   -1.91325000
 H                 -3.75105800    8.63016000   -2.09343300
 H                 -4.55052800   10.11371500   -1.57979700
 H                 -3.33439200   10.16770400   -2.86353500
 C                  5.52379600    9.92897200    1.93479300
 H                  5.66270900   10.56121400    2.81624300
 H                  4.74662700    9.20313700    2.19268300
 H                  6.45207900    9.38455100    1.74827800
 C                  6.32824500   11.42519600   -2.82519400
 H                  6.24663600   10.43980100   -3.29566100
 H                  5.99092100   12.16838200   -3.55141300
 H                  7.38976600   11.60377400   -2.62960900
 O                  3.14649300    9.97770800    5.24516300
 C                  2.32663400   10.21920200    4.39745500
 O                  1.75069000    9.20276300    3.64979800
 O                  1.81775500   11.34835400    4.06531800
 C                  2.28760100    7.88599200    3.69252200
 C                  2.25870400    7.32118500    2.29753200
 H                  1.67326000    7.27622800    4.36035700
 O                  1.13532200    7.68327200    1.49856500
 C                  2.43380000    8.15017600    1.10843900
 H                  2.53374400    6.27046200    2.24306500
 H                  2.83016300    7.70604000    0.20014800
 H                  2.59012100    9.21898900    1.22036600
 H                  3.30798100    7.91055900    4.07771100
 H                  4.02716483   10.08240104    4.87766267 
 






