%chk=000288062.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288062

0 1
O 5.594820 -0.211601 1.248674
O 1.280025 -1.516714 0.184092
O 4.063575 2.591313 0.074016
O -0.058096 0.257768 2.560143
N 3.304628 -0.555560 0.866456
N 2.130134 3.514710 -0.696453
N -2.572280 0.186970 1.172563
N -7.765617 -1.311912 -0.446151
N -0.856154 -0.614895 -1.833259
C 2.777849 0.574362 1.666017
C 2.020428 1.561812 0.815671
C 0.656022 1.610980 0.716571
C 4.777559 -1.958852 -0.280701
C 3.451256 -2.367164 -0.594021
C 4.719610 -0.803477 0.680321
C 2.484060 -1.485790 0.145198
C 2.848375 2.524250 0.087476
C 0.739679 3.555762 -0.749709
C 0.007254 2.618594 -0.049921
C 5.869109 -2.596358 -0.828535
C 3.209705 -3.413224 -1.457579
C -0.234374 0.616294 1.426641
C 2.941660 4.500789 -1.452882
C 0.076089 4.613057 -1.567602
C 5.625065 -3.672146 -1.715894
C 4.329141 -4.070236 -2.022532
C -1.423376 0.125487 0.593603
C -3.824099 -0.205380 0.652084
C -6.456448 -0.883258 -0.136135
C -4.941275 0.392938 1.283571
C -4.043428 -1.167876 -0.356510
C -6.230590 0.075288 0.886874
C -5.332329 -1.498700 -0.747063
C -1.100871 -0.303149 -0.747777
C -7.982605 -1.990705 -1.750932
C -8.894979 -0.418666 -0.076765
H 2.129216 0.170281 2.484381
H 3.649164 1.085089 2.156763
H -1.080324 2.649022 -0.080229
H 6.887303 -2.286062 -0.591158
H 2.193103 -3.724981 -1.701958
H 4.024287 4.302605 -1.282376
H 2.736321 5.528817 -1.115401
H 2.756433 4.421209 -2.535742
H 0.340386 4.532239 -2.634096
H 0.348341 5.626498 -1.234384
H -1.022123 4.547765 -1.512269
H 6.475157 -4.190344 -2.161743
H 4.161170 -4.900820 -2.709460
H -4.774912 1.116788 2.086170
H -3.199519 -1.677535 -0.825294
H -7.070802 0.554339 1.385510
H -5.472504 -2.252942 -1.519672
H -7.850437 -1.324241 -2.618322
H -9.001470 -2.411557 -1.784191
H -7.283264 -2.840749 -1.852035
H -9.850742 -0.946208 -0.233910
H -8.915985 0.521287 -0.651158
H -8.840516 -0.172510 0.999324


%chk=000288062-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000288062

0 1
O 5.128829 -0.574174 1.823172
O 0.948434 -1.036754 -0.294804
O 4.280484 2.200769 0.083175
O -0.479227 1.246442 2.427418
N 2.938928 -0.478203 0.881343
N 2.636469 3.589984 -0.879102
N -2.727186 0.536850 0.981091
N -7.721799 -1.727982 -0.402536
N -1.381393 0.893529 -2.307039
C 2.434058 0.694703 1.623738
C 1.975487 1.807262 0.695225
C 0.638677 2.160852 0.486093
C 4.346436 -2.140440 0.052963
C 3.085945 -2.287004 -0.574784
C 4.266223 -0.995166 1.019146
C 2.163864 -1.234947 -0.033930
C 3.045409 2.502423 -0.018786
C 1.305088 3.955206 -1.054177
C 0.310266 3.248089 -0.387965
C 5.417362 -2.994274 -0.248354
C 2.853237 -3.292190 -1.524864
C -0.491547 1.433058 1.179272
C 3.722879 4.305006 -1.586463
C 0.986288 5.106964 -1.977729
C 5.194539 -4.012608 -1.211936
C 3.931749 -4.159434 -1.840390
C -1.647851 0.939965 0.326321
C -3.913985 -0.011150 0.509777
C -6.487543 -1.169351 -0.101811
C -4.883008 -0.277249 1.532545
C -4.273719 -0.349430 -0.840819
C -6.130558 -0.833070 1.249112
C -5.517776 -0.911242 -1.133425
C -1.473036 0.915941 -1.111505
C -8.066552 -2.072017 -1.792803
C -8.695754 -1.994496 0.669841
H 1.618392 0.388267 2.296273
H 3.289308 1.045292 2.229761
H -0.730165 3.541316 -0.540678
H 6.386663 -2.871154 0.244801
H 1.873590 -3.395350 -2.002005
H 4.667715 3.832850 -1.276883
H 3.734971 5.373326 -1.310040
H 3.606409 4.211877 -2.680011
H 1.335836 4.913022 -3.009038
H 1.458602 6.049382 -1.642172
H -0.102741 5.263732 -2.013546
H 6.008342 -4.696790 -1.475789
H 3.789304 -4.955035 -2.579860
H -4.597488 -0.025177 2.558659
H -3.572649 -0.180195 -1.661429
H -6.829921 -1.013942 2.068995
H -5.745283 -1.159270 -2.173690
H -8.042456 -1.181297 -2.450133
H -9.084367 -2.489199 -1.823808
H -7.373517 -2.829012 -2.208993
H -9.603765 -2.440602 0.236857
H -8.987820 -1.063672 1.194052
H -8.290871 -2.701530 1.419971


