%chk=Scan.chk%nprocshared=12%mem=22GB#p opt=modredundant pm6 scrf=(solvent=butylamine,smd) nosymmScan0 1 C                 -2.79541200   -0.50952400   -0.64928600 C                 -2.39929700    0.98700800   -0.59707500 H                 -2.50889600   -0.96329100   -1.61104600 H                 -3.85813900   -0.71698200   -0.46237200 H                 -2.67122400    1.41976800   -1.58511700 O                 -1.03430600    1.01354700   -0.38957900 O                 -2.07685900   -1.15721700    0.43280200 C                 -0.79015400   -0.72528400    0.59696500 O                 -0.22089600   -0.78046200    1.66990600 C                 -3.15684600    1.74239700    0.50506500 H                 -2.79259500    2.77351400    0.54828200 H                 -4.24363700    1.76120500    0.32827200 H                 -2.96702700    1.27172500    1.47848700 N                  0.13240435   -1.55452279   -0.43592543 H                 -0.32628910   -2.44536863   -0.67198754 H                  0.14263199   -0.97884921   -1.25321347 C                  1.54391974   -1.77144752   -0.00145704 C                  2.36059159   -0.48490726   -0.02620988 H                  1.96158374   -2.51379323   -0.69250021 H                  1.50465656   -2.20289049    1.00267037 C                  3.81601378   -0.75393743    0.37436420 H                  2.32934185   -0.04877945   -1.03572320 H                  1.90864886    0.24706364    0.65201144 C                  4.66570019    0.52051314    0.38406882 H                  3.83586449   -1.21718493    1.37223492 H                  4.25778344   -1.48713431   -0.31795709 H                  5.70283828    0.30743565    0.67400836 H                  4.68525711    0.99136877   -0.60838872 H                  4.26303123    1.25663293    1.09269967 O                 -0.72027268    1.72851237   -2.43852693 O                  0.41833650   -0.30682538   -2.56560480 H                  1.37833650   -0.30682538   -2.56560480 H                  0.09788191    0.59811045   -2.56560480 H                 -0.84214845    0.83165881   -2.75852693 H                 -0.72027268    1.72851237   -1.47852693B 16 31 S 6 -0.1000B 33 30 S 5 -0.1000