%chk=000296018.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296018

0 1
O 3.537444 0.216859 -0.651103
N -2.759215 0.209908 -0.147418
C -1.863498 -0.026203 1.030328
C -0.421386 -0.013026 0.591685
C -4.184019 -0.124570 0.167560
C 0.086910 1.104835 -0.101603
C 0.420222 -1.092373 0.874972
C 1.415025 1.144445 -0.502353
C 1.765477 -1.076349 0.485440
C 2.246117 0.044021 -0.199296
C -5.013612 -0.118261 -1.115325
C 4.489495 -0.843365 -0.398708
H -2.100583 -0.965628 1.577836
H -2.040666 0.806864 1.752102
H -2.434915 -0.351438 -0.943093
H -4.299615 -1.100706 0.688387
H -4.559565 0.657673 0.865866
H -0.581056 1.939797 -0.327845
H 0.036067 -1.962343 1.406830
H 1.827433 1.995267 -1.039235
H 2.404265 -1.920601 0.716473
H -4.877009 0.821622 -1.668683
H -4.737738 -0.935685 -1.790270
H -6.081696 -0.216532 -0.893165
H 4.175755 -1.763559 -0.899468
H 4.621335 -0.988087 0.677255
H 5.402129 -0.438865 -0.855570


%chk=000296018-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296018

0 1
O 3.614165 0.279217 -0.705266
N -2.819619 -0.044113 -0.176982
C -1.886159 -0.325842 0.935555
C -0.431370 -0.211409 0.497918
C -4.250041 -0.057870 0.193012
C -0.008915 0.860385 -0.335513
C 0.536638 -1.145956 0.928865
C 1.337257 0.994187 -0.717160
C 1.898290 -1.026145 0.559573
C 2.297365 0.051485 -0.267268
C -5.136536 0.236163 -1.029227
C 4.643659 -0.661684 -0.262482
H -2.049108 -1.329696 1.404294
H -2.099887 0.419800 1.730814
H -2.627070 -0.643578 -0.991812
H -4.567216 -1.027310 0.656689
H -4.408832 0.723476 0.963315
H -0.759679 1.576771 -0.685145
H 0.230421 -1.985833 1.565395
H 1.671956 1.815633 -1.358404
H 2.620549 -1.768917 0.911548
H -4.870132 1.212347 -1.470746
H -5.010379 -0.539037 -1.809594
H -6.204105 0.255710 -0.744851
H 4.436305 -1.688121 -0.624176
H 4.735398 -0.670912 0.841531
H 5.580147 -0.295051 -0.708283


