%chk=000220533.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220533

0 1
O 5.995728 -1.094336 0.331861
O 6.080133 0.861428 -0.586044
N -2.437669 0.012236 -0.362327
N 5.475947 -0.061238 -0.060971
C -2.980551 1.366251 -0.709279
C -3.191601 -1.077873 -1.063137
C -4.209169 1.669041 0.187683
C -3.102841 -2.386555 -0.235816
C -0.967148 -0.077305 -0.628218
C -0.224360 0.494479 0.598629
C -3.775280 1.960493 1.627925
C -4.995260 2.849672 -0.396158
C -3.950205 -2.285167 1.036280
C -3.551344 -3.572441 -1.099342
C 1.258898 0.353165 0.431937
C 1.910157 -0.816125 0.865506
C 2.005540 1.383833 -0.167459
C 3.286255 -0.956911 0.708226
C 3.382347 1.254560 -0.330203
C 4.018665 0.081701 0.109108
H -3.258704 1.453352 -1.780613
H -2.201834 2.137610 -0.531598
H -2.829598 -1.252446 -2.097797
H -4.258979 -0.780766 -1.156797
H -4.873835 0.768217 0.198240
H -2.037464 -2.549382 0.064589
H -0.677114 -1.143284 -0.764109
H -0.650416 0.454474 -1.550047
H -0.581154 -0.028735 1.512951
H -0.513783 1.553908 0.758203
H -3.182832 2.877160 1.701265
H -4.639219 2.071256 2.290468
H -3.160605 1.136394 2.014837
H -4.383404 3.755579 -0.460714
H -5.861348 3.091520 0.230520
H -5.371832 2.630346 -1.400218
H -5.019039 -2.213751 0.812515
H -3.804750 -3.153382 1.685598
H -3.675809 -1.386976 1.607212
H -4.581326 -3.452925 -1.452244
H -3.514641 -4.507955 -0.529515
H -2.911897 -3.701084 -1.978210
H 1.333665 -1.617610 1.328684
H 1.504756 2.290494 -0.506697
H 3.803993 -1.862273 1.043693
H 3.974026 2.051350 -0.794115


%chk=000220533-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220533

0 1
O 6.133714 -1.026516 0.405567
O 6.127672 0.901330 -0.814388
N -2.438818 -0.001329 -0.405243
N 5.531235 -0.008844 -0.116376
C -3.004382 1.341760 -0.698380
C -3.167399 -1.110382 -1.075499
C -4.253418 1.691284 0.152757
C -3.143206 -2.447786 -0.288489
C -0.972480 -0.078586 -0.566901
C -0.211298 0.478143 0.676358
C -3.882205 1.854579 1.643011
C -4.936835 2.963230 -0.401174
C -3.898977 -2.320919 1.052327
C -3.727930 -3.583747 -1.160264
C 1.291070 0.372184 0.506096
C 2.010700 -0.723666 1.054889
C 2.004707 1.339107 -0.254738
C 3.398313 -0.859276 0.858674
C 3.391533 1.225326 -0.464604
C 4.071234 0.121297 0.096648
H -3.260587 1.439322 -1.783213
H -2.226346 2.103633 -0.491884
H -2.772570 -1.286800 -2.108052
H -4.224484 -0.802718 -1.193415
H -4.969877 0.847595 0.067799
H -2.084286 -2.697931 -0.064808
H -0.684963 -1.137409 -0.701550
H -0.619537 0.463479 -1.479316
H -0.553089 -0.089904 1.559702
H -0.507621 1.532924 0.830365
H -3.240966 2.746371 1.790520
H -4.784253 1.981876 2.269595
H -3.329378 0.967922 2.000358
H -4.248321 3.829929 -0.360041
H -5.832912 3.221557 0.192288
H -5.251680 2.830722 -1.453731
H -4.980245 -2.155828 0.875658
H -3.793168 -3.238839 1.659809
H -3.512212 -1.465650 1.633883
H -4.780061 -3.368899 -1.431276
H -3.713211 -4.546051 -0.616756
H -3.156008 -3.712701 -2.098682
H 1.473995 -1.473751 1.646928
H 1.465057 2.195046 -0.676520
H 3.964751 -1.694355 1.279147
H 3.953840 1.963268 -1.042775


