%chk=Before.chk
%nprocshared=4
%mem=6GB
#p opt=(noeigentest) iop(1/8=10) freq=noraman wb97xd/6-311G** nosymm scrf=(smd,solvent=butanone)

IC

0 1
 O                  3.41590600    9.95046000    3.83077100
 C                  3.12002500   10.06648600    5.24987000
 C                  3.01748300    8.77312700    4.59012900
 H                  3.98445400   10.29949700    5.85688600
 H                  2.21893700   10.63024400    5.47362300
 H                  3.84413100    8.08124700    4.72029700
 C                  1.70948900    8.10164300    4.24127600
 H                  1.86517300    7.40991200    3.41017000
 H                  1.37487500    7.53839400    5.11464300
 O                  0.70573100    9.01919700    3.85818100
 H                  1.02430300   10.07935200    2.93300200
 C                 -0.16029400    9.64189100    4.92702900
 O                 -0.20650400    9.03388200    5.97338000
 O                 -0.63285600   10.67145600    4.46518300
 H                  2.44064100   10.72909400    2.98920000
 O                  1.52968100   10.97627400    2.55866100
 H                  1.11371300   11.77723800    3.02603200
 

   
     


