%chk=000232944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000232944

0 1
O -0.789005 -0.608488 -2.272262
N 1.674461 -0.897550 0.245466
N -2.676814 0.468197 2.084203
N -2.721692 0.930205 -4.692473
C 2.570998 -2.103090 0.349560
C 2.202627 0.248565 1.061710
C 4.054761 -1.788597 0.039394
C 3.651211 0.630527 0.676949
C 4.579026 -0.580567 0.824083
C 1.407276 -0.550002 -1.185487
C 2.403421 -2.735850 1.737562
C 1.277800 1.466543 0.989890
C 0.274706 -1.438858 -1.716150
C -1.703721 -0.030356 -1.440123
C -2.706167 0.712726 -2.123741
C -1.697733 -0.142413 -0.048966
C -2.710356 0.502474 0.687822
C -3.708742 1.338236 -1.357276
C -3.727901 1.239734 0.025121
C -2.708523 0.827395 -3.538969
H 2.211738 -2.849702 -0.408556
H 2.202228 -0.123953 2.123399
H 4.168830 -1.601735 -1.045438
H 4.675824 -2.676593 0.257777
H 4.004297 1.460448 1.314983
H 3.684133 1.014927 -0.358641
H 4.685003 -0.845295 1.894244
H 5.596411 -0.320525 0.474955
H 2.304798 -0.638464 -1.833652
H 1.088122 0.517505 -1.268299
H 2.877927 -3.721255 1.778690
H 1.341930 -2.861957 1.983727
H 2.848499 -2.121506 2.528145
H 0.241273 1.193727 1.233970
H 1.256212 1.921289 -0.008297
H 1.590775 2.240707 1.697543
H -0.143336 -2.122289 -0.956514
H 0.562992 -2.005236 -2.621959
H -0.902442 -0.692676 0.456215
H -4.485364 1.909808 -1.872923
H -4.506555 1.734023 0.596253
H -2.087772 -0.208770 2.541626
H -3.499956 0.729091 2.600841


%chk=000232944-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000232944

0 1
O -0.632463 -0.087549 -2.386596
N 1.718997 -0.566487 0.031797
N -2.458060 -0.349389 2.159741
N -3.164025 1.244938 -4.494662
C 2.262415 -1.909968 0.441481
C 2.331684 0.559374 0.821052
C 3.822260 -1.949920 0.390675
C 3.884206 0.568142 0.731945
C 4.463169 -0.791141 1.191711
C 1.705658 -0.400371 -1.446102
C 1.705041 -2.352225 1.813738
C 1.716754 1.928462 0.472379
C 0.473825 -1.039696 -2.128897
C -1.650803 0.082681 -1.445222
C -2.868677 0.640870 -1.952154
C -1.512513 -0.242167 -0.083779
C -2.599446 -0.032505 0.811244
C -3.938423 0.850841 -1.037903
C -3.822003 0.517403 0.319022
C -3.014400 0.966194 -3.339040
H 1.881223 -2.635328 -0.305624
H 2.067661 0.348784 1.878746
H 4.151741 -1.874661 -0.665909
H 4.179172 -2.929093 0.764744
H 4.286816 1.392087 1.353254
H 4.189796 0.774272 -0.314873
H 4.269952 -0.923736 2.275910
H 5.562323 -0.808324 1.064903
H 2.616863 -0.833970 -1.921996
H 1.700723 0.670642 -1.707835
H 2.018905 -3.388318 2.036758
H 0.600272 -2.322898 1.801210
H 2.058825 -1.713422 2.641984
H 0.615916 1.863875 0.413642
H 2.093355 2.330989 -0.486074
H 1.980687 2.661530 1.256124
H 0.094495 -1.903312 -1.548403
H 0.743799 -1.374931 -3.145193
H -0.532940 -0.585356 0.281198
H -4.873572 1.275123 -1.417510
H -4.663587 0.684125 1.000563
H -1.588035 -0.737852 2.512554
H -3.216386 -0.187314 2.815800


