%chk=000287618.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287618

0 1
O 1.614966 0.215442 0.002927
O 0.540415 2.236266 0.021753
N -0.618942 0.175874 0.002513
C 5.349894 0.346699 0.003249
C 6.382549 -0.788100 -0.008929
C 3.920286 -0.206404 -0.002538
C 7.816775 -0.240399 -0.003192
C 2.904087 0.928610 0.009717
C 8.849102 -1.365287 -0.015406
C -3.007350 -0.410942 -0.003019
C -1.981417 0.611158 0.006534
C -4.363617 0.009321 0.000863
C -2.316315 1.951054 0.019015
C -2.722924 -1.812495 -0.016075
C -4.682317 1.403593 0.013851
C 0.491910 1.025947 0.010464
C -5.401839 -0.978137 -0.008368
C -3.681083 2.341467 0.022619
C -3.736058 -2.738638 -0.024734
C -5.096163 -2.315128 -0.020822
H 5.505793 0.986250 0.894409
H 5.505648 1.005099 -0.874103
H 6.230287 -1.429718 -0.898379
H 6.230426 -1.448539 0.866660
H 3.753333 -0.849394 -0.890694
H 3.753489 -0.868258 0.871685
H 7.972666 0.399581 0.887480
H 7.972481 0.418613 -0.879907
H 2.939580 1.569445 -0.887416
H 2.940312 1.550588 0.919990
H 9.869642 -0.965733 -0.011754
H 8.749298 -2.015663 0.861113
H 8.748443 -1.997288 -0.905170
H -0.440654 -0.836007 -0.006922
H -1.545812 2.730082 0.026296
H -1.684234 -2.145769 -0.019155
H -5.728642 1.701470 0.016601
H -6.437867 -0.641381 -0.005256
H -3.912097 3.407497 0.032550
H -3.518256 -3.805242 -0.034670
H -5.881297 -3.070135 -0.027880


%chk=000287618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287618

0 1
O 1.570355 0.153787 0.048045
O 0.537170 2.271991 0.021870
N -0.681478 0.227698 0.010306
C 5.391178 0.302034 0.069570
C 6.478400 -0.789155 -0.053105
C 3.957432 -0.274594 -0.000653
C 7.916456 -0.228769 0.032305
C 2.899023 0.824706 0.088151
C 8.996408 -1.324446 -0.097982
C -3.062426 -0.381965 0.001238
C -2.037762 0.645972 -0.016387
C -4.452104 0.032396 -0.029417
C -2.393824 2.003721 -0.058827
C -2.777703 -1.788513 0.049314
C -4.781472 1.426445 -0.074441
C 0.457992 1.018683 0.025937
C -5.480648 -0.967695 -0.012751
C -3.767249 2.383645 -0.087637
C -3.801964 -2.739231 0.065001
C -5.169727 -2.327077 0.033192
H 5.526422 0.846942 1.026966
H 5.532267 1.050239 -0.738167
H 6.352099 -1.326690 -1.015991
H 6.332982 -1.545338 0.746562
H 3.822355 -0.832950 -0.947099
H 3.802921 -0.995974 0.824975
H 8.043074 0.304904 0.996385
H 8.059792 0.530067 -0.763932
H 2.962526 1.536004 -0.756146
H 2.974556 1.399320 1.030519
H 10.014778 -0.898821 -0.036231
H 8.895949 -2.078133 0.705922
H 8.909166 -1.853559 -1.065767
H -0.487610 -0.773780 0.021268
H -1.609299 2.762654 -0.068436
H -1.745696 -2.159094 0.078094
H -5.835881 1.723886 -0.097640
H -6.526503 -0.638939 -0.036542
H -4.015759 3.449883 -0.121575
H -3.555748 -3.805853 0.103043
H -5.965949 -3.079003 0.045963


