Gaussian 16 23-Apr-2024 Gaussian 16 25-Dec-2016 ES64L-G16RevA.03 12 12 13 14 219 (5D, 7F) def2TZVPP 30 C1[X(C3H9)] UwB97XD def2TZVPP SP #uwb97xd/def2TZVPP Pop=NBORead 36.0321 0 2 AuxInfo=1/0/N:1;4;9;2;3;5;6;7;8;10;11;12/rA:12nC0H0H0C0H0H0H0H0C0H0H0H0/rB:;;;;;;;;;;;/rC:0,-.0001,0;0,-.3203,-1.0435;0,1.0637,.2444;-1.9234,0,0;-2.241,.3082,1.0039;-2.241,.7154,-.7688;-2.2413,-1.0234,-.2351;0,-.7437,.799;1.9234,0,0;2.241,.7154,-.7688;2.2411,.3082,1.0039;2.2412,-1.0234,-.2351; /u/local/apps/gaussian/16_sse4/g16 /u/local/apps/gaussian/16_sse4/l1.exe "/work/2940758.1.pod_smp.q/Gau-30484.inp" -scrdir="/work/2940758.1.pod_smp.q/" nproc=8 mem=16GB # uwb97xd/def2TZVPP Pop=NBORead 1/38=1,172=1/1 2/12=2,17=6,18=5,40=1/2 3/5=44,7=202,11=2,25=1,30=1,74=-58,116=2/1,2,3 4//1 5/5=2,38=5/2 6/7=2,8=2,9=2,10=2,28=1,40=2/1,7 99/5=1,9=1/99 Title Card Required 243 A 219 A 306 243 78.7762282552 12 1.00e+00 60 F 0 0 0 0 0 0 0 0 0 0 0 0 36.0321 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(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) (A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A)|(A) GINC-N1897 HUILINGS 23-Apr-2024 0 Title Card Required 0 2 Version=ES64L-G16RevA.03 State=2-A HF=-119.5948545 S2=0.77375 S2-1=0. S2A=0.750133 RMSD=5.210e-09 Dipole=-0.0000019,0.0000098,0.0000016 Quadrupole=-2.124999,1.0625882,1.0624108,0.0000049,0.0000034,-0.0000178 PG=C01 [X(C3H9)] 0 -0.000001 -0.000081 -0.00002 0 0.000002 -0.320325 -1.043505 0 -0.000003 1.063721 0.244395 0 -1.923361 0.000028 0.000006 0 -2.241042 0.308201 1.003887 0 -2.241044 0.71539 -0.768756 0 -2.241258 -1.023371 -0.235063 0 0. -0.743684 0.799021 0 1.92336 0.000028 0.000006 0 2.241048 0.715388 -0.768756 0 2.241055 0.308201 1.003884 0 2.241252 -1.023373 -0.235063