%chk=000200844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200844

0 1
O 4.180602 -1.648617 0.095100
N 2.123587 0.353506 -0.029749
C 1.334212 1.476209 -0.665414
C -0.155126 1.072703 -0.796501
C 3.565191 0.725424 0.168251
C 2.060840 -0.892197 -0.868511
C 4.286910 -0.436910 0.869565
C 2.807006 -2.020075 -0.139922
C 1.463794 2.757277 0.171386
C -0.815423 0.720373 0.543960
C -2.192921 0.156495 0.328881
C -3.296681 1.013747 0.195620
C -2.384950 -1.231836 0.251987
C -4.574370 0.487030 -0.009327
C -3.664823 -1.753788 0.047265
C -4.762158 -0.896907 -0.084006
H 1.715717 1.693134 -1.700513
H -0.708940 1.901975 -1.278169
H -0.250952 0.212572 -1.489977
H 3.619195 1.626622 0.814950
H 4.081402 0.969370 -0.784890
H 2.493597 -0.750319 -1.882242
H 0.994431 -1.179303 -1.001415
H 5.378417 -0.281256 0.918364
H 3.877901 -0.621006 1.878821
H 2.332550 -2.267690 0.826027
H 2.908467 -2.925209 -0.763162
H 1.314410 2.550763 1.239682
H 2.446259 3.226157 0.058091
H 0.713607 3.498328 -0.125735
H -0.857887 1.616246 1.194758
H -0.171900 0.000994 1.096772
H -3.157070 2.090849 0.252587
H -1.535445 -1.903420 0.355003
H -5.426610 1.156689 -0.110471
H -3.807694 -2.831472 -0.009121
H -5.757444 -1.304856 -0.242343


%chk=000200844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000200844

0 1
O 4.307109 -1.645274 0.109992
N 2.161860 0.349603 -0.051674
C 1.350651 1.444666 -0.681592
C -0.145173 1.040200 -0.804669
C 3.581066 0.733461 0.190039
C 2.129632 -0.911894 -0.844065
C 4.335948 -0.403294 0.897168
C 2.906767 -2.026155 -0.125502
C 1.488697 2.770895 0.102565
C -0.821253 0.679690 0.548123
C -2.230532 0.142142 0.354116
C -3.347785 1.016605 0.310061
C -2.459028 -1.247432 0.173631
C -4.652982 0.520916 0.089903
C -3.761555 -1.749510 -0.047075
C -4.864933 -0.865732 -0.091208
H 1.721633 1.627891 -1.726483
H -0.686326 1.883999 -1.276340
H -0.261234 0.188877 -1.501714
H 3.618124 1.625315 0.838533
H 4.105919 0.980227 -0.768555
H 2.563546 -0.759576 -1.865388
H 1.085047 -1.247008 -0.968481
H 5.403231 -0.152510 1.016140
H 3.880871 -0.583148 1.895711
H 2.413318 -2.254266 0.844835
H 2.947508 -2.938925 -0.743013
H 1.329395 2.608051 1.183508
H 2.476954 3.242164 -0.035952
H 0.730512 3.490645 -0.254829
H -0.847495 1.578388 1.193105
H -0.183127 -0.062726 1.062394
H -3.192470 2.093356 0.456276
H -1.609082 -1.940909 0.218084
H -5.503186 1.212463 0.064171
H -3.917501 -2.826725 -0.177768
H -5.876424 -1.252868 -0.258447


