%chk=000280350.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280350

0 1
O -0.241760 -1.478536 -0.406461
N -1.748207 0.263001 -0.587105
N 0.556121 0.703065 -0.199528
C -2.910936 -0.677668 -0.551306
C -3.341360 -1.003313 0.894101
C -4.065684 -0.060878 -1.365139
C -4.019409 0.178598 1.594501
C -4.754723 1.105856 -0.646863
C -5.196574 0.715639 0.769662
C -0.456450 -0.277352 -0.381431
C 1.956669 0.420935 -0.090195
C 2.833293 1.524254 -0.052948
C 2.464337 -0.887152 0.005673
C 4.720783 0.010051 0.183761
C 4.205123 1.310259 0.084992
C 3.836532 -1.081512 0.141542
C 6.189437 -0.224143 0.329854
H -2.574926 -1.631403 -1.048355
H -2.463170 -1.343745 1.477540
H -4.032452 -1.868731 0.869029
H -4.806260 -0.858479 -1.573285
H -3.692403 0.271114 -2.353992
H -3.285000 0.985265 1.776908
H -4.373794 -0.135744 2.595092
H -5.631883 1.436550 -1.235863
H -4.077382 1.979337 -0.603694
H -5.993343 -0.051396 0.714097
H -5.648363 1.587515 1.278225
H -1.958636 1.208617 -0.276566
H 0.314383 1.688763 -0.303832
H 2.455672 2.540168 -0.129188
H 1.787365 -1.748415 -0.030882
H 4.877313 2.166381 0.114448
H 4.226030 -2.096586 0.214962
H 6.414432 -0.779360 1.251528
H 6.582855 -0.813419 -0.510806
H 6.766268 0.708365 0.367023


%chk=000280350-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280350

0 1
O -0.311305 -1.635088 -0.234495
N -1.756851 0.172525 -0.518950
N 0.546086 0.570891 -0.324107
C -2.960610 -0.688602 -0.576163
C -3.447479 -1.098684 0.841517
C -4.085474 0.032015 -1.359037
C -4.043497 0.094099 1.624407
C -4.694980 1.222649 -0.574877
C -5.179699 0.780658 0.827479
C -0.490307 -0.382690 -0.347074
C 1.939234 0.344282 -0.145551
C 2.794845 1.477973 -0.156838
C 2.507717 -0.945220 0.040885
C 4.771296 0.050969 0.201516
C 4.186621 1.328134 0.014172
C 3.901227 -1.070187 0.210650
C 6.270318 -0.117248 0.383515
H -2.655846 -1.603954 -1.115870
H -2.603113 -1.555019 1.388689
H -4.220756 -1.885794 0.724526
H -4.886589 -0.707948 -1.553718
H -3.704331 0.361878 -2.344856
H -3.244050 0.833588 1.838281
H -4.420788 -0.251342 2.605896
H -5.532356 1.657380 -1.153676
H -3.947452 2.038336 -0.462360
H -6.021258 0.066826 0.708579
H -5.573768 1.650387 1.387991
H -1.888958 1.184365 -0.546786
H 0.285673 1.549012 -0.466051
H 2.371503 2.481671 -0.299634
H 1.853368 -1.818578 0.047365
H 4.825751 2.219326 0.001090
H 4.323363 -2.073267 0.353132
H 6.508569 -0.605755 1.347378
H 6.706198 -0.747406 -0.414991
H 6.791596 0.855720 0.363463


