%chk=000184954.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184954

0 1
O 2.133124 0.149661 -1.497400
O -1.981515 -0.943112 1.093782
N 1.443731 0.991502 0.491554
N 1.955788 2.954523 1.524447
C 1.556524 -2.576236 -0.228981
C 0.647488 -1.296784 -0.207080
C -0.522695 -1.356416 -1.207777
C 2.063421 -2.883155 -1.643941
C 0.735081 -3.765659 0.300767
C 2.755527 -2.333532 0.707315
C 1.464992 -0.054113 -0.509503
C -1.456480 -0.189230 -1.063611
C -2.233824 -0.003445 0.107314
C -1.603472 0.742601 -2.094224
C 0.656463 1.070971 1.674459
C 2.219404 2.197056 0.457106
C -3.138652 1.054060 0.235914
C -2.501589 1.811929 -1.979056
C -3.265356 1.962457 -0.821639
C 0.984224 2.266384 2.285857
C -2.833154 -0.936517 2.264692
H 0.199299 -1.238140 0.824451
H -0.131994 -1.420679 -2.245281
H -1.089748 -2.299589 -1.035844
H 2.817863 -3.676740 -1.634433
H 2.529759 -1.998982 -2.105432
H 1.259359 -3.209777 -2.309949
H 1.324709 -4.689027 0.282012
H -0.161712 -3.942609 -0.303795
H 0.408038 -3.609259 1.333742
H 3.443825 -1.580032 0.306323
H 2.444412 -2.004920 1.703686
H 3.342541 -3.249593 0.840734
H -1.008609 0.638704 -3.003522
H -0.050459 0.303612 1.941969
H 2.909689 2.406516 -0.350122
H -3.732732 1.187414 1.133703
H -2.597196 2.525720 -2.794534
H -3.964192 2.794102 -0.732443
H 0.610553 2.692826 3.200296
H -2.450050 -1.797074 2.827850
H -3.877444 -1.092498 1.977896
H -2.701041 -0.006820 2.825700


%chk=000184954-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184954

0 1
O 1.948317 0.261102 -1.731263
O -2.344448 -1.259408 0.883158
N 1.735190 1.041576 0.442738
N 2.644520 2.915513 1.364253
C 1.540173 -2.457455 -0.124891
C 0.633363 -1.154658 -0.220084
C -0.534824 -1.269987 -1.251455
C 1.992165 -2.949003 -1.524093
C 0.719601 -3.570974 0.582500
C 2.794719 -2.152358 0.740816
C 1.471667 0.068999 -0.582809
C -1.561333 -0.159824 -1.096174
C -2.483283 -0.171354 -0.007336
C -1.638120 0.911885 -2.014295
C 1.262794 1.112267 1.777023
C 2.567343 2.169945 0.257601
C -3.454792 0.844849 0.142745
C -2.599680 1.940864 -1.874794
C -3.507819 1.901273 -0.796487
C 1.825425 2.258490 2.317587
C -3.332341 -1.388504 1.957043
H 0.179325 -1.024219 0.776664
H -0.112289 -1.244568 -2.270168
H -1.025949 -2.247168 -1.100808
H 2.679740 -3.808392 -1.412501
H 2.515997 -2.152640 -2.080644
H 1.133129 -3.284265 -2.132662
H 1.328693 -4.490795 0.662603
H -0.201630 -3.827473 0.029947
H 0.427074 -3.264668 1.604607
H 3.474245 -1.437038 0.241998
H 2.519331 -1.732434 1.726918
H 3.365240 -3.082793 0.917620
H -0.929854 0.934055 -2.850991
H 0.577910 0.385196 2.199455
H 3.061374 2.360114 -0.690511
H -4.165677 0.829373 0.974491
H -2.637170 2.759602 -2.600605
H -4.259368 2.689662 -0.677655
H 1.701280 2.663109 3.319343
H -3.062466 -2.313830 2.487524
H -4.358056 -1.477045 1.550168
H -3.285619 -0.530922 2.656427


