%chk=000191924.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191924

-1 1
O 0.140024 -1.550561 -0.499426
O -5.881718 -0.712943 -1.205753
N -4.730922 -0.664431 -0.639401
N 5.315394 -0.459422 -0.516721
C 0.227016 -0.660422 0.625034
C -1.010699 -0.787680 1.546741
C 1.491119 -1.163602 1.378812
C 0.343182 0.769168 0.103676
C -2.316446 -0.761414 0.765316
C 2.802805 -0.890598 0.707279
C 1.133688 1.727825 0.750194
C -0.398706 1.141706 -1.028762
C -2.713836 -1.918084 0.123605
C -3.046165 0.421152 0.696100
C -3.920685 -1.930895 -0.752207
C 2.964038 -1.038652 -0.680454
C 3.923112 -0.522548 1.471825
C -4.312812 0.405412 0.032927
C 1.203113 3.035199 0.256721
C -0.329907 2.447778 -1.518743
C 0.475281 3.396937 -0.879819
C 4.221018 -0.812371 -1.249347
C 5.150489 -0.318052 0.823726
H -0.963065 -1.731107 2.121488
H -1.004140 0.029623 2.291385
H 1.480177 -0.762527 2.410134
H 1.384208 -2.270204 1.476011
H -0.827340 -1.747736 -0.730748
H 1.702435 1.464394 1.638436
H -1.052630 0.407894 -1.508484
H -2.250030 -2.869606 0.293777
H -2.704083 1.340143 1.128334
H -4.591731 -2.784841 -0.509442
H -3.642828 -2.042327 -1.825135
H 2.098352 -1.315464 -1.296208
H 3.845402 -0.393508 2.545665
H -4.955033 1.285404 0.067355
H 1.824294 3.769412 0.761419
H -0.916416 2.726661 -2.391141
H 0.527614 4.411977 -1.261939
H 4.380718 -0.911485 -2.327768
H 6.042413 -0.029608 1.387838


%chk=000191924-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191924

-1 1
O 0.258708 -1.654580 -0.531215
O -5.975287 -0.520255 -1.072270
N -4.770936 -0.474715 -0.476749
N 5.383662 -0.770620 -0.800328
C 0.319307 -0.769239 0.523478
C -0.923716 -0.982251 1.567336
C 1.621489 -1.040041 1.442607
C 0.334803 0.728337 0.081175
C -2.266800 -0.820571 0.934580
C 2.915405 -0.934410 0.681410
C 0.362832 1.822122 0.985755
C 0.322266 1.007619 -1.306816
C -2.623949 -1.792048 -0.178241
C -3.192455 0.147647 1.278019
C -3.625825 -1.177720 -1.167834
C 3.196502 -1.821539 -0.397219
C 3.897003 0.049005 0.971340
C -4.496970 0.208219 0.652386
C 0.374687 3.156214 0.517147
C 0.336985 2.338197 -1.783352
C 0.361740 3.421549 -0.873296
C 4.417387 -1.699436 -1.093265
C 5.096090 0.089977 0.225201
H -0.783442 -2.030986 1.902455
H -0.816154 -0.313280 2.444407
H 1.635822 -0.365022 2.321601
H 1.481600 -2.077711 1.803554
H -1.652279 -2.022960 -0.689600
H 0.370178 1.638515 2.068571
H 0.307021 0.133611 -1.969541
H -3.008297 -2.739879 0.257187
H -2.983807 0.863921 2.081506
H -4.090853 -1.921300 -1.833217
H -3.116174 -0.411155 -1.785472
H 2.429268 -2.546770 -0.684741
H 3.725685 0.778193 1.772805
H -5.325960 0.788464 1.065550
H 0.391713 3.988562 1.233229
H 0.330620 2.532848 -2.863890
H 0.370674 4.456126 -1.239585
H 4.649892 -2.369929 -1.930624
H 5.868264 0.837887 0.448258


