%chk=000289067.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289067

0 1
O 0.170176 -1.839616 0.880289
O 0.182872 -0.715938 -3.610461
N -1.318012 -0.154357 -1.892061
N 0.445117 -1.537900 -1.409870
N 2.861319 -1.522105 -1.934439
C -1.373232 -0.335825 -0.404311
C -0.181170 -1.327881 -0.149182
C -2.655743 -1.011819 0.051151
C -1.150075 1.008878 0.268404
C -0.182418 -0.774632 -2.460684
C 1.691113 -2.346381 -1.618499
C -2.789147 -1.314608 1.417586
C -2.248347 1.855115 0.486025
C -3.687119 -1.337463 -0.836994
C 0.136371 1.433677 0.628921
C -3.950985 -1.927520 1.887506
C -2.059995 3.112756 1.063927
C -4.850709 -1.951030 -0.359079
C 0.318839 2.692845 1.208493
C -4.986153 -2.244245 0.999912
C -0.776296 3.533933 1.426277
C 3.399762 -0.638138 -0.946059
C 3.178711 -0.823570 0.430388
C 4.244253 0.406171 -1.383538
C 4.648884 1.050864 0.926151
C 3.804438 0.016062 1.352569
C 4.862825 1.233917 -0.450828
C 5.327973 1.941109 1.915847
H -1.730042 0.675829 -2.307069
H 1.862753 -2.941871 -0.684161
H 1.509826 -3.044999 -2.475108
H -1.974193 -1.081530 2.107743
H -3.253302 1.529157 0.213501
H -3.592967 -1.128448 -1.903000
H 1.009166 0.794615 0.471089
H 2.817223 -1.114173 -2.876908
H -4.049437 -2.162761 2.946497
H -2.915865 3.764741 1.233957
H -5.650757 -2.203361 -1.053641
H 1.321609 3.015482 1.489220
H -5.892406 -2.722269 1.368400
H -0.630740 4.514257 1.877844
H 2.525972 -1.620636 0.791874
H 4.424175 0.560015 -2.445325
H 3.630812 -0.142168 2.416793
H 5.520027 2.031676 -0.794860
H 5.315140 2.992385 1.599387
H 4.863458 1.897841 2.909240
H 6.381999 1.650919 2.040288


%chk=000289067-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289067

0 1
O 0.058857 -1.679493 1.060456
O 0.156772 -0.666238 -3.530503
N -1.352496 -0.043130 -1.791502
N 0.362132 -1.405148 -1.270287
N 2.754989 -1.404135 -1.858259
C -1.502275 -0.252904 -0.329565
C -0.276275 -1.195327 -0.046935
C -2.787209 -1.025412 0.033808
C -1.367124 1.096780 0.411627
C -0.256103 -0.682041 -2.343451
C 1.608696 -2.198440 -1.494029
C -3.074074 -1.278197 1.400159
C -2.524005 1.869145 0.684786
C -3.657374 -1.527650 -0.961793
C -0.091567 1.628806 0.728717
C -4.222631 -2.013022 1.760534
C -2.408503 3.151597 1.264898
C -4.812521 -2.258334 -0.598099
C 0.022100 2.908071 1.314627
C -5.099943 -2.502169 0.763195
C -1.134652 3.675571 1.582731
C 3.500710 -0.615166 -0.955029
C 3.277789 -0.633191 0.449789
C 4.534451 0.221464 -1.464764
C 5.125365 0.976181 0.809782
C 4.087619 0.148764 1.304109
C 5.323931 0.998293 -0.596776
C 6.005637 1.792737 1.741209
H -1.873457 0.665443 -2.305902
H 1.779323 -2.758534 -0.559449
H 1.398237 -2.907415 -2.311240
H -2.390500 -0.909842 2.172088
H -3.515894 1.463071 0.457022
H -3.429519 -1.356629 -2.019026
H 0.819580 1.052028 0.530990
H 2.825529 -1.163023 -2.847976
H -4.432154 -2.206538 2.818343
H -3.310779 3.737842 1.471495
H -5.481661 -2.638788 -1.377953
H 1.013927 3.302854 1.560410
H -5.993180 -3.070749 1.045087
H -1.044336 4.668394 2.037369
H 2.480498 -1.242889 0.888541
H 4.717310 0.255443 -2.546561
H 3.897028 0.112766 2.384153
H 6.112738 1.633168 -1.019989
H 6.185758 2.809227 1.344978
H 5.548090 1.895733 2.740975
H 6.996870 1.318027 1.880415


