%chk=000194252.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194252

0 1
O -3.353056 0.428431 1.568071
O 6.553831 0.264429 0.593154
N -6.785800 0.477103 0.596399
C -1.896536 0.405182 -0.419525
C -1.121236 -0.826571 0.150130
C 0.312624 -0.872597 -0.390225
C 1.042589 0.409977 0.099909
C -3.327435 0.114984 0.165920
C -1.203272 1.674338 0.100191
C -2.066295 -2.012326 -0.111761
C 0.277519 1.685981 -0.319929
C -3.474479 -1.428772 0.139504
C 2.501333 0.451349 -0.427944
C 1.068396 -2.112147 0.109095
C -1.955369 0.420227 -1.953220
C 2.493407 -2.133424 -0.448600
C 3.243964 -0.852361 -0.209397
C -4.473958 0.877614 -0.536742
C 3.257719 1.630027 0.225298
C 4.741181 1.632763 -0.134732
C 4.554657 -0.888734 0.088781
C 5.396224 0.313748 0.233683
C -5.756727 0.651794 0.100896
H -1.064465 -0.700497 1.266273
H 0.294076 -0.885180 -1.506072
H 1.078678 0.377537 1.217345
H -1.276774 1.717122 1.205510
H -1.703284 2.582670 -0.279844
H -1.856066 -2.858393 0.562002
H -1.966886 -2.396592 -1.139683
H 0.348677 1.821282 -1.416459
H 0.767292 2.574159 0.125300
H -4.196725 -1.760919 -0.620173
H -3.874317 -1.764599 1.118524
H 2.475677 0.614510 -1.537577
H 0.535480 -3.033956 -0.192458
H 1.094782 -2.129195 1.216545
H -0.947893 0.339021 -2.384746
H -2.531086 -0.422423 -2.351516
H -2.390143 1.347566 -2.337339
H 2.469996 -2.321962 -1.544882
H 3.042410 -2.998450 -0.019420
H -4.536389 0.571116 -1.608606
H -4.247220 1.968393 -0.558035
H 3.147205 1.578067 1.328041
H 2.798884 2.589775 -0.081868
H -3.375053 1.389851 1.728521
H 5.267688 2.466490 0.372730
H 4.891293 1.810922 -1.218750
H 5.091880 -1.826027 0.242485


%chk=000194252-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194252

0 1
O -3.299051 0.314715 1.677662
O 6.580848 0.299759 0.930630
N -6.866927 0.379204 0.722952
C -1.927024 0.401999 -0.435266
C -1.132012 -0.841137 0.082711
C 0.322220 -0.890894 -0.423351
C 1.058998 0.410259 0.024417
C -3.336911 0.098257 0.211366
C -1.205585 1.679278 0.057881
C -2.079339 -2.032539 -0.201977
C 0.282743 1.691446 -0.390309
C -3.508489 -1.443342 0.041803
C 2.543681 0.450159 -0.483550
C 1.079334 -2.131137 0.098272
C -2.058079 0.427145 -1.983194
C 2.538650 -2.145429 -0.416877
C 3.278278 -0.848750 -0.145388
C -4.505065 0.940971 -0.378132
C 3.294128 1.692995 0.065929
C 4.820334 1.623499 -0.147729
C 4.562702 -0.862533 0.336599
C 5.410826 0.342295 0.440587
C -5.806230 0.631181 0.238799
H -1.089237 -0.727044 1.187867
H 0.326804 -0.938062 -1.535358
H 1.097351 0.385102 1.137796
H -1.226529 1.710239 1.166451
H -1.703372 2.599022 -0.313356
H -1.879145 -2.894453 0.456890
H -1.967276 -2.384885 -1.245645
H 0.346529 1.816684 -1.490584
H 0.768533 2.580836 0.051309
H -4.198016 -1.676372 -0.788957
H -3.965091 -1.836132 0.965190
H 2.499578 0.522537 -1.596711
H 0.568422 -3.057227 -0.226107
H 1.071817 -2.127293 1.207411
H -1.072220 0.397980 -2.476552
H -2.638275 -0.430545 -2.368068
H -2.555060 1.355718 -2.321173
H 2.508904 -2.298923 -1.518441
H 3.099469 -2.999089 0.005410
H -4.591083 0.769151 -1.465905
H -4.298331 2.022015 -0.238097
H 3.086465 1.775826 1.152559
H 2.902315 2.610963 -0.407990
H -3.205693 1.284818 1.863363
H 5.336677 2.491690 0.297914
H 5.052085 1.630808 -1.233698
H 5.043348 -1.809462 0.615452


