%chk=Prod-H.chk %nprocshared=8 %mem=22GB #p opt=(noeigentest) iop(1/8=10) freq=noraman b97d3/6-311G** nosymm scrf=(smd,solvent=butanone) IC 0 1 O 1.87293300 8.66301700 -5.30677600 C 2.30939800 9.71761800 -4.47366400 C 3.77549200 9.95875800 -4.74802300 H 2.20003000 9.47071800 -3.40896300 H 1.75760600 10.64463800 -4.66997300 H 4.15406400 10.73440200 -4.08399300 C 4.63947300 8.69407600 -4.71856200 H 4.14864500 7.85350600 -4.23257700 H 5.61940700 8.87001600 -4.27338400 O 4.81673900 8.37848300 -6.10539000 C 4.42685800 9.41229400 -6.85799700 O 3.94768900 10.41055600 -6.10400400 O 4.51796900 9.45211500 -8.04752100 H 0.92463200 8.56886200 -5.19933100