%chk=000133706.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000133706

0 1
O 6.016160 -3.259543 -0.577261
N -2.507020 0.667989 -0.525425
N -5.820089 -0.927683 0.276903
N 3.737915 1.679170 0.527477
C -0.118840 0.319962 -0.324850
C 2.270022 -0.050162 -0.141131
C 0.072923 1.723395 0.083259
C 1.047737 -0.557013 -0.434558
C 2.465266 1.377556 0.283660
C 1.304450 2.242497 0.378497
C -3.863805 0.100859 -0.730873
C -1.387340 -0.146844 -0.593988
C 3.623663 -0.602873 -0.128742
C -4.451056 -0.423616 0.601327
C -1.143299 2.525271 0.152304
C 4.488533 0.481391 0.284556
C -2.366854 2.017239 -0.128008
C 0.857529 -1.975275 -0.863374
C 1.549749 3.653910 0.796803
C -5.828669 -2.420787 0.115728
C -6.846255 -0.468650 1.269508
C 4.149488 -1.850454 -0.414207
C 5.862077 0.303028 0.405851
C 5.544269 -1.996023 -0.280931
C -7.048841 -2.847577 -0.700634
C -7.110911 1.027681 1.101440
C 6.399568 -0.959719 0.117642
H -4.538094 0.878101 -1.160581
H -3.826467 -0.712710 -1.489073
H -1.568430 -1.187623 -0.891020
H -3.784247 -1.192007 1.044984
H -4.487394 0.403541 1.343725
H -1.029963 3.573331 0.442724
H -3.285844 2.605015 -0.079027
H 0.222967 -2.531564 -0.161029
H 1.816854 -2.523860 -0.914116
H 0.414664 -2.039907 -1.866459
H 0.642268 4.266089 0.829980
H 2.019814 3.682717 1.793224
H 2.264325 4.138763 0.111513
H -4.906131 -2.721745 -0.428481
H -5.812447 -2.957580 1.089299
H -7.788765 -1.028998 1.068968
H -6.560922 -0.694459 2.319666
H 3.532444 -2.689198 -0.728063
H 6.502124 1.126853 0.717439
H -7.985807 -2.694786 -0.152247
H -7.126030 -2.264770 -1.628884
H -6.989538 -3.906840 -0.972178
H -6.255017 1.638441 1.407403
H -7.326596 1.272506 0.052451
H -7.973466 1.341222 1.700017
H 7.467682 -1.125174 0.204337
H 6.994843 -3.318684 -0.473843


%chk=000133706-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133706

0 1
O 6.140000 -3.336309 -0.485823
N -2.516597 0.695792 -0.545599
N -5.859792 -0.901360 0.346252
N 3.769589 1.682361 0.481165
C -0.105660 0.334064 -0.332664
C 2.283909 -0.075507 -0.140171
C 0.086604 1.759825 0.045235
C 1.018945 -0.584487 -0.425188
C 2.470675 1.356105 0.239959
C 1.367281 2.266280 0.328665
C -3.875126 0.135525 -0.740303
C -1.403853 -0.117462 -0.600980
C 3.643503 -0.631148 -0.111685
C -4.516191 -0.338829 0.591550
C -1.119774 2.563187 0.089555
C 4.491231 0.483069 0.270143
C -2.364503 2.046956 -0.190627
C 0.779940 -2.032226 -0.819612
C 1.674569 3.695869 0.719471
C -5.833619 -2.350861 0.006170
C -6.862086 -0.550089 1.388780
C 4.218970 -1.898743 -0.358206
C 5.886441 0.314017 0.397201
C 5.616887 -2.045665 -0.226166
C -7.020702 -2.786408 -0.873782
C -7.319787 0.918354 1.308146
C 6.449546 -0.955510 0.147310
H -4.524108 0.902702 -1.195778
H -3.811015 -0.708243 -1.450056
H -1.600834 -1.154176 -0.882664
H -3.830599 -1.066916 1.088039
H -4.596933 0.529638 1.269641
H -1.056613 3.622020 0.350021
H -3.280308 2.641320 -0.169265
H 0.118381 -2.549157 -0.097220
H 1.720182 -2.594773 -0.858858
H 0.308968 -2.110795 -1.818720
H 0.789006 4.351263 0.744679
H 2.159192 3.720576 1.712904
H 2.412864 4.126973 0.019008
H -4.895614 -2.551832 -0.546153
H -5.793096 -2.981927 0.929022
H -7.741992 -1.200477 1.236808
H -6.478053 -0.772761 2.415546
H 3.646390 -2.783328 -0.647837
H 6.512060 1.164071 0.685732
H -7.989054 -2.636767 -0.363496
H -7.037029 -2.201217 -1.809556
H -6.940102 -3.859975 -1.126330
H -6.481842 1.621795 1.468273
H -7.756747 1.126972 0.316172
H -8.080429 1.128548 2.082600
H 7.534109 -1.103443 0.241377
H 7.122012 -3.336488 -0.370985


