%chk=000233091.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000233091

0 1
O 3.957709 -0.884438 0.679486
O -1.869254 -0.963587 -0.339211
O -0.861297 -0.136737 -2.230370
N 0.235589 -0.184146 -0.164929
C 1.579165 0.208931 -0.695013
C 2.305123 0.921858 0.418434
C 2.339503 -1.006793 -1.171148
C 3.420501 0.346681 1.043725
C 3.448566 -1.493498 -0.468181
C 1.874758 2.178552 0.875105
C 1.950101 -1.692862 -2.333151
C 4.102940 0.969470 2.101991
C 4.158820 -2.638759 -0.861588
C 2.538404 2.817187 1.922080
C 2.641707 -2.830618 -2.747681
C -0.814733 -0.407039 -1.045079
C 3.646739 2.211404 2.535015
C 3.738322 -3.304390 -2.010512
C -3.841195 0.197569 -1.258884
C -3.126286 -1.136379 -1.068205
C -4.550497 0.681845 -0.024975
C -5.888463 1.097027 -0.098972
C -3.873671 0.741885 1.203698
C -6.539905 1.567092 1.045381
C -4.529679 1.210154 2.343418
C -5.864015 1.624826 2.267499
H 1.411513 0.909191 -1.565250
H 0.199039 -0.583638 0.773023
H 1.007845 2.648852 0.406487
H 1.091645 -1.326758 -2.908508
H 4.962378 0.479719 2.555087
H 5.010348 -2.978270 -0.276308
H 2.195991 3.790662 2.268448
H 2.329782 -3.355718 -3.648842
H 4.156375 2.718772 3.355069
H 4.268481 -4.197900 -2.341745
H -3.103838 0.968836 -1.586334
H -4.545836 0.109118 -2.112970
H -2.901902 -1.625748 -2.032775
H -3.658253 -1.824906 -0.384611
H -6.423940 1.056763 -1.044766
H -2.834040 0.413495 1.260897
H -7.578019 1.888837 0.982477
H -4.000738 1.253154 3.293969
H -6.372881 1.990506 3.156220


%chk=000233091-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000233091

0 1
O 3.821779 -0.904230 0.906627
O -2.112391 -0.862078 -0.904307
O -0.819340 0.280810 -2.520824
N 0.101764 -0.546413 -0.521562
C 1.496034 -0.113242 -0.791697
C 2.028343 0.725605 0.365850
C 2.401694 -1.306301 -1.089454
C 3.120785 0.296137 1.156601
C 3.477281 -1.656826 -0.240291
C 1.417644 1.960891 0.695654
C 2.164803 -2.115125 -2.228418
C 3.585609 1.054057 2.254898
C 4.285971 -2.787090 -0.492279
C 1.870099 2.736083 1.781232
C 2.963789 -3.242380 -2.502923
C -0.919572 -0.318861 -1.414555
C 2.956908 2.274219 2.566747
C 4.025260 -3.580907 -1.625529
C -3.895458 0.814997 -1.468759
C -3.330290 -0.602053 -1.714308
C -4.344635 1.057049 -0.035990
C -5.689313 0.822545 0.351491
C -3.423913 1.493730 0.951365
C -6.104043 1.013503 1.689269
C -3.833099 1.686158 2.289845
C -5.175674 1.445517 2.664320
H 1.407739 0.512730 -1.700275
H -0.106250 -1.069905 0.331074
H 0.573522 2.305970 0.086381
H 1.337573 -1.848015 -2.896826
H 4.431022 0.675421 2.836871
H 5.102697 -3.017461 0.198172
H 1.386202 3.689526 2.016238
H 2.765807 -3.853513 -3.389323
H 3.315021 2.866907 3.415259
H 4.649994 -4.457390 -1.828108
H -3.126199 1.546444 -1.776737
H -4.751582 0.938095 -2.161010
H -3.079469 -0.731719 -2.782540
H -4.033027 -1.383026 -1.382513
H -6.418004 0.494170 -0.401002
H -2.381218 1.684027 0.669460
H -7.148078 0.831390 1.968964
H -3.107642 2.023949 3.038841
H -5.495237 1.596806 3.701571


