%chk=000231942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231942

0 1
O 2.997377 1.801037 0.390960
O 3.955350 -0.427915 -0.263403
O -4.127874 0.567229 1.461456
O -4.862692 -0.510362 -0.261183
N -3.962768 -0.035577 0.410207
C -0.133751 -0.210490 0.498178
C -2.560210 -0.204651 -0.074402
C -2.437357 -0.498737 -1.539373
C -1.564351 -0.060159 0.813320
C 0.699533 0.928917 0.609302
C 2.053497 0.804906 0.341270
C 0.395463 -1.443844 0.135292
C 2.601242 -0.471203 -0.034815
C 1.772544 -1.579244 -0.131212
C -2.596349 0.770431 -2.373839
C 2.546048 3.122571 0.780533
C 4.602279 -1.670568 -0.635282
H -3.203648 -1.249175 -1.843064
H -1.451730 -0.967695 -1.749162
H -1.776268 0.196052 1.864817
H 0.264977 1.882376 0.897144
H -0.244821 -2.321553 0.062321
H 2.164543 -2.554221 -0.408061
H -1.865208 1.536690 -2.089564
H -2.452790 0.558149 -3.440327
H -3.597925 1.205717 -2.263229
H 2.142945 3.105107 1.796890
H 1.822659 3.508298 0.057059
H 3.484682 3.692178 0.739962
H 4.204702 -2.039604 -1.584574
H 4.505049 -2.407573 0.166587
H 5.646152 -1.346186 -0.746009


%chk=000231942-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000231942

0 1
O 3.292894 1.521965 1.386316
O 4.095986 -0.452147 -0.176083
O -3.787106 2.239201 0.502195
O -4.979402 0.494336 -0.351586
N -3.855470 1.052953 -0.018285
C -0.052020 0.474494 -0.049955
C -2.610468 0.276356 -0.268682
C -2.833163 -1.096591 -0.855277
C -1.441177 0.906219 0.087165
C 0.923085 1.197744 0.711293
C 2.289003 0.874732 0.666260
C 0.407838 -0.572735 -0.895191
C 2.729655 -0.198118 -0.182457
C 1.777031 -0.897850 -0.959100
C -2.992277 -1.090890 -2.400273
C 2.887007 2.626101 2.262131
C 4.591517 -1.536817 -1.032333
H -3.753732 -1.518006 -0.414792
H -1.994915 -1.748147 -0.552273
H -1.586603 1.886759 0.562720
H 0.578631 2.016050 1.351707
H -0.286932 -1.111882 -1.541498
H 2.102594 -1.698584 -1.629276
H -2.116758 -0.638704 -2.900947
H -3.114625 -2.121857 -2.778193
H -3.887898 -0.513833 -2.687215
H 2.185872 2.280097 3.046141
H 2.424224 3.448883 1.683403
H 3.820142 2.976589 2.725615
H 4.386392 -1.329000 -2.099893
H 4.145404 -2.508179 -0.745365
H 5.676571 -1.558236 -0.858474


