%chk=000182558.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182558

0 1
O 3.983466 0.291825 -1.277663
N -3.131872 1.148844 0.462705
C -0.693504 1.008959 -0.175503
C -1.806131 0.580256 0.832687
C -1.830152 -0.945640 1.118207
C -1.127487 0.839457 -1.655121
C 0.596026 0.219517 0.054649
C -2.084619 -1.917758 -0.052509
C -0.488635 -1.277869 1.805691
C -0.416001 2.527993 0.053723
C -1.325135 -0.608619 -2.107820
C -2.484162 -1.324656 -1.405928
C 0.688810 -0.849261 0.975262
C 1.730461 0.572515 -0.688128
C 0.249200 2.837677 1.391558
C 1.901135 -1.533817 1.141441
C 2.926602 -0.131741 -0.500316
C 3.039262 -1.188502 0.410314
H -1.541577 1.074717 1.817938
H -2.646083 -1.120812 1.864923
H -0.362695 1.307329 -2.309113
H -2.051291 1.424243 -1.834834
H -2.868994 -2.634908 0.262323
H -1.175553 -2.537634 -0.212392
H -0.439114 -2.362062 2.028900
H -0.435592 -0.773748 2.793949
H -1.382715 3.071172 -0.013977
H 0.212581 2.922248 -0.766785
H -0.384816 -1.177725 -1.955057
H -1.501615 -0.616199 -3.202123
H -3.352073 -0.643376 -1.299911
H -2.842620 -2.149388 -2.056018
H -3.825175 0.907967 1.165448
H -3.462790 0.759381 -0.422185
H 1.708108 1.388504 -1.408319
H -0.338902 2.444090 2.231375
H 1.252346 2.398499 1.457058
H 0.350936 3.918337 1.538277
H 1.963699 -2.355293 1.855442
H 3.971101 -1.723243 0.546689
H 4.800473 -0.233276 -1.105857


%chk=000182558-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182558

0 1
O 4.060736 0.258788 -1.299778
N -3.123400 1.172138 0.488530
C -0.688959 1.005906 -0.156727
C -1.819517 0.560288 0.838017
C -1.839663 -0.977464 1.115435
C -1.156472 0.858171 -1.645455
C 0.605315 0.192515 0.077240
C -2.039564 -1.961738 -0.088733
C -0.513470 -1.301708 1.850448
C -0.419768 2.538771 0.067099
C -1.393763 -0.569991 -2.187823
C -2.476826 -1.411695 -1.470568
C 0.691706 -0.880070 1.016202
C 1.758988 0.532124 -0.672379
C 0.235637 2.936495 1.406723
C 1.920317 -1.568562 1.166562
C 2.973432 -0.160752 -0.504374
C 3.067903 -1.223584 0.424289
H -1.554137 1.005736 1.818623
H -2.673833 -1.136308 1.830414
H -0.390016 1.335108 -2.288724
H -2.073107 1.468896 -1.766383
H -2.768886 -2.735359 0.224489
H -1.084925 -2.499220 -0.259567
H -0.449620 -2.383321 2.080252
H -0.500893 -0.773141 2.827572
H -1.400460 3.042775 -0.032238
H 0.218297 2.909290 -0.759817
H -0.439196 -1.133402 -2.158968
H -1.667624 -0.477775 -3.258656
H -3.427993 -0.845028 -1.402149
H -2.707029 -2.287988 -2.110963
H -3.745944 1.278485 1.295602
H -3.605480 0.726629 -0.296812
H 1.736687 1.348182 -1.401467
H -0.394377 2.671142 2.276222
H 1.219355 2.450514 1.538271
H 0.391878 4.030770 1.443009
H 1.977562 -2.398547 1.881922
H 4.008314 -1.773596 0.560053
H 4.863701 -0.285472 -1.106394


