%chk=000203324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203324

0 1
O -2.413196 -0.060462 -0.698681
O 1.503446 -1.394200 1.730088
O 1.376281 2.511372 -0.665854
N -0.554873 1.245979 -0.625951
N 1.459275 0.529817 0.514508
C -0.574312 -0.986587 0.571823
C -0.523984 -2.296464 -0.254358
C -1.374606 -1.176604 1.886665
C -1.281086 0.067689 -0.287338
C 0.867624 -0.669579 0.996160
C 0.805365 1.507129 -0.293759
C -1.273408 2.325255 -1.386313
C 2.914434 0.767079 0.805362
C 0.341303 -2.166789 -1.474445
C -2.740167 -1.767630 1.690139
C -1.747540 3.399497 -0.445237
C 3.758990 0.324492 -0.359000
C -0.145048 -2.089071 -2.710685
C -3.237315 -2.721568 2.473571
C -3.029139 3.727944 -0.307906
C 4.676870 -0.633559 -0.265315
H -0.145300 -3.119900 0.392066
H -1.563238 -2.591258 -0.524225
H -0.769985 -1.813217 2.575798
H -1.480554 -0.198718 2.405843
H -2.116587 1.852655 -1.946786
H -0.572908 2.760330 -2.140533
H 3.172944 0.222179 1.745787
H 3.067751 1.857348 0.996297
H 1.415838 -2.154896 -1.275776
H -3.315931 -1.339664 0.860498
H -0.950877 3.902615 0.107863
H 3.567509 0.864990 -1.289212
H 0.481387 -2.010338 -3.588845
H -1.201672 -2.097904 -2.945352
H -4.231427 -3.127472 2.345895
H -2.704391 -3.171098 3.298827
H -3.369552 4.515652 0.350778
H -3.838161 3.239897 -0.835605
H 5.300398 -0.937408 -1.095491
H 4.879239 -1.190234 0.640596


%chk=000203324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000203324

0 1
O -2.315182 -0.078169 -0.952493
O 1.622414 -1.654815 1.371413
O 1.387883 2.673393 -0.330762
N -0.485093 1.305757 -0.592569
N 1.499146 0.504927 0.524289
C -0.531316 -0.999575 0.437195
C -0.657512 -2.382440 -0.289655
C -1.303149 -1.046815 1.830257
C -1.179245 0.084534 -0.430793
C 0.942211 -0.760471 0.798528
C 0.828294 1.559650 -0.139438
C -1.171905 2.423673 -1.320785
C 2.925204 0.757283 0.916634
C 0.184170 -2.474887 -1.546672
C -2.742088 -1.507728 1.744717
C -1.819158 3.404334 -0.361277
C 3.878828 0.534926 -0.242331
C -0.320151 -2.554544 -2.803558
C -3.235209 -2.560009 2.444619
C -3.158549 3.591288 -0.270520
C 4.809701 -0.449723 -0.268038
H -0.340377 -3.154578 0.436197
H -1.723667 -2.538345 -0.521896
H -0.724789 -1.725153 2.483829
H -1.261508 -0.032757 2.280393
H -1.924399 1.953945 -1.972347
H -0.404495 2.929105 -1.930848
H 3.147884 0.067843 1.745373
H 2.979115 1.802286 1.265810
H 1.275270 -2.491028 -1.399810
H -3.404696 -0.929564 1.087421
H -1.129835 3.989317 0.263074
H 3.791103 1.243765 -1.077085
H 0.333337 -2.630442 -3.680302
H -1.401595 -2.544557 -2.987282
H -4.291821 -2.843258 2.381016
H -2.599581 -3.166096 3.102851
H -3.588389 4.324755 0.421074
H -3.861064 3.015286 -0.885119
H 5.496419 -0.565742 -1.114142
H 4.907191 -1.168074 0.554929


