%chk=000217448.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217448

1 1
O 1.845619 1.041255 0.394195
N -2.079790 -0.250594 -0.402025
C -0.579397 -0.309175 -0.721518
C -2.319238 0.781416 0.714290
C -2.808830 0.174186 -1.660803
C -2.574853 -1.618045 0.012222
C 0.281370 -0.808108 0.449395
C -3.767347 0.887078 1.146236
C 1.678506 -0.354810 0.267004
C 2.883068 -0.957580 0.018247
C 3.873911 0.092345 -0.013236
C 3.217211 1.271037 0.214281
H -0.415072 -0.961417 -1.611839
H -0.236834 0.714241 -1.024143
H -1.673837 0.506761 1.587977
H -1.949090 1.773972 0.357143
H -2.657489 -0.545137 -2.487569
H -3.901100 0.250321 -1.493529
H -2.468022 1.165209 -2.016284
H -2.169563 -1.920570 0.995700
H -3.678525 -1.646008 0.097119
H -2.285746 -2.395786 -0.719526
H 0.259051 -1.919029 0.524444
H -0.094269 -0.426793 1.429903
H -3.875890 1.682894 1.908813
H -4.453198 1.165553 0.334231
H -4.155510 -0.025200 1.619894
H 3.091897 -2.002573 -0.124551
H 4.926734 -0.057227 -0.183333
H 3.480933 2.304683 0.291863


%chk=000217448-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217448

1 1
O 2.053354 1.071807 0.122049
N -2.107460 -0.204225 -0.348881
C -0.570403 -0.087553 -0.559950
C -2.538438 0.734565 0.813442
C -2.775927 0.232836 -1.651694
C -2.489653 -1.650186 -0.053110
C 0.316799 -0.618620 0.590207
C -4.042245 0.767702 1.106220
C 1.752327 -0.303592 0.280546
C 2.908264 -1.049384 0.131434
C 3.989319 -0.116541 -0.124847
C 3.440321 1.151251 -0.125462
H -0.344056 -0.636959 -1.490588
H -0.361112 0.982747 -0.726916
H -1.983732 0.392492 1.701750
H -2.164482 1.736285 0.538247
H -2.431151 -0.422652 -2.465972
H -3.867373 0.152537 -1.553871
H -2.494188 1.274671 -1.868153
H -2.123203 -1.931936 0.944309
H -3.583508 -1.753123 -0.086818
H -2.035694 -2.300663 -0.816716
H 0.225196 -1.712231 0.700755
H 0.039305 -0.154484 1.556046
H -4.197550 1.448934 1.961336
H -4.641905 1.166093 0.271496
H -4.444986 -0.213884 1.406861
H 2.993858 -2.132178 0.205016
H 5.036557 -0.363384 -0.284247
H 3.836465 2.152574 -0.267890


