21-May-2010 Gaussian 03 1-Mar-2006 AM64L-G03RevD.02 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 134.0724 AuxInfo=1/0/N:4;7;10;13;21;1;16;19;22;23;2;3;5;6;8;9;11;12;14;15;17;18;20/rA:23nN0H0H0C0H0H0C0H0H0C0H0H0C0H0H0N0H0H0N0H0C0O0O0/rB:;;;;;;;;;;;;;;;;;;;;;;/rC:1.2011,-.7293,-.3475;.8854,.2416,-.5608;1.4749,-1.2087,-1.2324;2.3586,-.6066,.5741;2.8069,-1.5925,.7097;2.0653,-.2408,1.5647;.0625,-1.427,.3009;.3406,-2.4684,.4717;-.2051,-.9917,1.2692;3.405,.3558,-.0305;4.319,.323,.5715;3.6546,.0213,-1.0377;-1.1746,-1.3897,-.627;-1.9638,-2.0183,-.2038;-.901,-1.7898,-1.6032;2.8318,1.7263,-.1273;3.5279,2.3223,-.6033;2.7757,2.1078,.8313;-1.6505,-.001,-.8301;-1.9992,.1886,-1.7748;-2.5166,.5377,.1663;-2.6198,.1495,1.3669;-3.1636,1.5146,-.3131; /usr/local/gaussian/g03.D02/g03/g03 /usr/local/gaussian/g03.D02/g03/l1.exe /globalscratch/cpye/Gau-2288.inp -scrdir=/globalscratch/cpye/ mem=1Gb rwf=/globalscratch/cpye/ NoSave chk=NH2Et2NH2NHCOO_C1_1_CPCM #N hf/sto-3g FOpt=(CalcFC,z-matrix) Freq SCRF=(CPCM,Read,Solvent=H2O) 1/10=4,14=-1,18=40,38=1,40=2/1,3 2/14=103,17=6,18=5,29=3,40=1/2 3/6=3,11=9,16=1,25=1,30=1,70=2103,71=2,72=1/1,2,3 4//1 5/5=2,38=5,53=1/2 8/6=4,10=90,11=11/1 11/6=1,8=1,9=11,15=111,16=1/1,2,10 10/6=1,7=6/2 6/7=2,8=2,9=2,10=2,28=1/1 7/10=1,18=20,25=1/1,2,3,16 1/10=4,14=-1,18=40/3(3) 2/29=3/2 6/7=2,8=2,9=2,10=2,19=2,28=1/1 99//99 2/29=3/2 3/6=3,11=9,16=1,25=1,30=1,70=2105,71=1,72=1/1,2,3 4/5=5,16=3/1 5/5=2,38=5,53=1/2 7//1,2,3,16 1/14=-1,18=40/3(-5) 2/29=3/2 6/7=2,8=2,9=2,10=2,19=2,28=1/1 99/9=1/99 NH2Et2NH2NHCOO_C1_1_CPCM 0 1 Berny optimization. 3.00e-01 1.00e-07 1.00e-07 73 126 2.1103629 0.5729292 0.5127623