%chk=000183282.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183282

0 1
O -1.959320 -4.415667 -1.939043
N -3.363237 0.263260 0.670124
N 4.542936 0.491345 0.687096
N 0.951097 0.198417 -1.277210
N 0.297037 2.160535 -0.107168
C -1.251572 0.284276 -0.243214
C -2.221706 1.050822 0.496434
C -1.834762 -0.998259 -0.536481
C -3.154839 -0.996938 0.036576
C 0.009762 0.881768 -0.532929
C 3.369876 -0.401631 -1.295641
C 3.666879 -0.622605 0.199923
C 2.325986 0.701576 -1.520496
C -1.925265 2.369420 0.922738
C -1.374124 -2.131369 -1.219358
C -4.005147 -2.105417 -0.066236
C -4.609836 0.652019 1.338047
C 5.995010 0.135604 0.551043
C 4.207827 0.904955 2.089957
C -0.655074 2.847674 0.584683
C -2.241308 -3.220403 -1.307490
C -2.883222 3.223507 1.679639
C -3.543216 -3.224684 -0.742867
C 6.844694 1.407950 0.544825
C 2.843246 1.590712 2.130152
C -0.673557 -4.551629 -2.587170
H 3.051925 -1.353601 -1.757470
H 4.302703 -0.106701 -1.820655
H 4.116839 -1.625957 0.350934
H 2.707595 -0.628325 0.765550
H 2.376301 1.081242 -2.565571
H 2.548386 1.575014 -0.853009
H 0.756531 -0.765608 -1.535707
H -0.384581 -2.141591 -1.658906
H -5.000975 -2.092193 0.370025
H -4.403584 1.048689 2.349251
H -5.143605 1.427223 0.758140
H -5.282994 -0.215632 1.448502
H 6.137027 -0.397607 -0.415119
H 6.346474 -0.554209 1.348594
H 4.232598 0.055403 2.805828
H 4.987334 1.627058 2.424115
H -0.346373 3.860242 0.879054
H -2.454114 4.206171 1.921179
H -3.796115 3.412892 1.098794
H -3.168365 2.760663 2.634056
H -4.158663 -4.114337 -0.855434
H 6.449227 2.136107 -0.177163
H 6.847576 1.903537 1.522264
H 7.881564 1.189248 0.273276
H 2.759523 2.359386 1.345378
H 2.018009 0.890993 1.949883
H 2.670351 2.075445 3.094576
H -0.569046 -3.810749 -3.384956
H 0.132142 -4.479040 -1.851558
H -0.737060 -5.566703 -3.000884


%chk=000183282-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183282

0 1
O -1.845473 -4.501147 -1.618166
N -3.392214 0.421105 0.567854
N 4.480315 0.327412 0.641351
N 1.027388 0.274942 -1.197029
N 0.332403 2.266615 -0.141275
C -1.229530 0.398445 -0.230074
C -2.228705 1.203330 0.424835
C -1.802894 -0.916430 -0.465177
C -3.146191 -0.861490 0.035220
C 0.044414 0.987414 -0.521939
C 3.429295 -0.250466 -1.571183
C 3.787854 -0.726736 -0.143938
C 2.334700 0.836892 -1.576629
C -1.942598 2.545320 0.822651
C -1.321700 -2.131980 -1.024437
C -4.015116 -1.971526 -0.029430
C -4.687137 0.770415 1.156348
C 5.935868 0.389420 0.341345
C 4.195142 0.263975 2.100722
C -0.634438 2.979224 0.510488
C -2.195908 -3.241220 -1.088365
C -2.889010 3.496499 1.531513
C -3.530777 -3.162281 -0.600139
C 6.553888 1.774871 0.613423
C 2.763248 0.706304 2.458544
C -0.492274 -4.656367 -2.146282
H 3.108475 -1.123904 -2.180364
H 4.329857 0.159534 -2.068211
H 4.399492 -1.662257 -0.202887
H 2.848571 -0.991911 0.373580
H 2.277491 1.317117 -2.577117
H 2.585331 1.623752 -0.847875
H 0.742944 -0.588403 -1.658019
H -0.290706 -2.230223 -1.374789
H -5.039763 -1.924690 0.352529
H -4.698756 1.821131 1.465506
H -5.498357 0.616886 0.419587
H -4.898196 0.141508 2.042542
H 6.069229 0.152227 -0.730950
H 6.501574 -0.395484 0.907737
H 4.390946 -0.761337 2.510293
H 4.906127 0.942457 2.607003
H -0.338128 3.996252 0.799996
H -2.370098 4.450624 1.732115
H -3.784634 3.739071 0.926500
H -3.234273 3.105000 2.508164
H -4.160563 -4.053432 -0.676231
H 6.027631 2.545947 0.024254
H 6.483684 2.056876 1.679284
H 7.624799 1.782235 0.335698
H 2.563664 1.715565 2.059273
H 1.997910 0.029118 2.039129
H 2.631299 0.720377 3.556862
H -0.302899 -3.959608 -2.987591
H 0.271865 -4.500980 -1.358397
H -0.440272 -5.693692 -2.508952


