%chk=000239978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239978

0 1
O 3.906113 -1.318091 -1.006579
O -3.844256 -1.367524 -1.284755
N 2.399549 0.100939 0.986370
N -2.346535 -0.115066 0.815371
N 0.038494 -0.019534 0.692594
N -1.308394 2.014026 0.456486
C 2.437408 -1.391159 0.951398
C 3.640230 0.675616 0.389348
C -3.640715 0.455934 0.339995
C -2.288565 -1.588910 0.594515
C 2.698604 -1.904575 -0.472270
C 3.879662 0.122555 -1.026216
C -3.907732 0.065629 -1.121701
C -2.582510 -1.934086 -0.874135
C 1.177403 0.752774 0.713664
C -1.176133 0.638693 0.616913
C 1.104310 2.164528 0.576698
C -0.162019 2.737678 0.450537
H 1.488980 -1.810997 1.357840
H 3.254067 -1.711003 1.637888
H 4.485482 0.392388 1.059733
H 3.597369 1.786017 0.382571
H -3.649922 1.564146 0.464354
H -4.436854 0.049808 1.004859
H -3.054817 -2.045990 1.262050
H -1.300872 -1.994401 0.910327
H 2.935022 -2.982950 -0.496584
H 1.857480 -1.683727 -1.152518
H 3.108573 0.460872 -1.740149
H 4.885986 0.369783 -1.409481
H -4.942997 0.289792 -1.434649
H -3.191507 0.540655 -1.814646
H -1.787476 -1.574999 -1.550560
H -2.751529 -3.014769 -1.026712
H 1.995643 2.778798 0.592257
H -0.286143 3.822349 0.331788


%chk=000239978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239978

0 1
O 4.708319 -1.390802 -0.383560
O -4.567922 -1.508733 -0.736877
N 2.351963 0.084809 0.384258
N -2.348188 -0.075859 0.382674
N 0.004049 0.036578 0.390828
N -1.366730 2.066362 0.436270
C 2.386411 -1.389653 0.501793
C 3.681113 0.718130 0.457170
C -3.697787 0.519471 0.416924
C -2.325214 -1.548068 0.345065
C 3.362365 -1.979589 -0.529321
C 4.632544 0.065331 -0.569544
C -4.533315 -0.032700 -0.753707
C -3.198287 -2.046776 -0.824532
C 1.151332 0.785565 0.413806
C -1.198659 0.695397 0.403550
C 1.079183 2.217964 0.459016
C -0.207820 2.783349 0.465489
H 1.362190 -1.764136 0.349834
H 2.719979 -1.669708 1.523480
H 4.103288 0.593351 1.477089
H 3.610866 1.796067 0.243800
H -3.590990 1.614160 0.359340
H -4.190358 0.253867 1.375255
H -2.728617 -1.947715 1.298733
H -1.280323 -1.877412 0.234613
H 3.498913 -3.061853 -0.371263
H 2.985002 -1.796224 -1.558414
H 4.282602 0.295644 -1.599570
H 5.662824 0.434971 -0.437039
H -5.586271 0.284133 -0.674638
H -4.108411 0.319299 -1.718673
H -2.738154 -1.744198 -1.790463
H -3.312302 -3.143199 -0.795587
H 1.955795 2.864754 0.500826
H -0.327989 3.872622 0.499978


