%chk=000261851.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261851

0 1
O -5.475438 2.851657 0.434851
O 6.791194 0.814937 0.409636
N -3.596963 -0.434405 0.203320
N 3.009590 0.570791 0.274501
C -1.155022 -0.961105 0.166245
C 1.358655 -1.294121 0.243100
C 0.208842 -0.447067 -0.334242
C -1.336907 -2.444386 -0.208596
C 1.175239 -2.778790 -0.132910
C -0.188599 -3.297689 0.343717
C -2.287699 -0.093924 -0.430856
C 2.728032 -0.790248 -0.271883
C -4.706848 0.539209 -0.040117
C 4.367329 1.124396 -0.024321
C -4.369409 1.948455 0.548840
C 5.498522 0.216566 0.560933
C -5.954021 -0.009352 0.673853
C -4.967879 0.657375 -1.550543
C 4.545505 1.258172 -1.545486
C 4.448288 2.507531 0.643922
H -1.178692 -0.871166 1.279852
H 1.336929 -1.209409 1.357275
H 0.243408 -0.469040 -1.439135
H 0.355735 0.613449 -0.051765
H -2.308804 -2.811629 0.173972
H -1.392893 -2.550948 -1.308260
H 1.257355 -2.904044 -1.229222
H 1.983390 -3.389246 0.309099
H -0.223156 -3.305763 1.449920
H -0.319497 -4.350016 0.028481
H -2.383117 -0.295469 -1.521032
H -2.024549 0.981527 -0.329827
H 2.708559 -0.715932 -1.381519
H 3.516482 -1.531003 -0.017231
H -3.473786 -0.590633 1.209082
H 2.830097 0.588820 1.283833
H -4.203200 1.908664 1.640450
H -3.487767 2.398740 0.062167
H 5.510664 -0.782239 0.093688
H 5.411473 0.106756 1.657006
H -6.781661 0.708918 0.606968
H -5.779066 -0.191819 1.738943
H -6.280170 -0.956521 0.229108
H -5.035612 -0.342036 -2.003808
H -5.914668 1.167508 -1.753362
H -4.171531 1.194626 -2.073154
H 4.660745 0.290163 -2.041129
H 5.415305 1.874533 -1.793128
H 3.666275 1.746474 -1.989793
H 3.731490 3.206241 0.197644
H 4.239889 2.465827 1.717839
H 5.456566 2.928482 0.534427
H -5.727580 2.957694 -0.505011
H 6.979177 0.974687 -0.537741


%chk=000261851-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261851

0 1
O -5.768050 2.858194 -0.391727
O 6.875341 0.975663 -0.429246
N -3.454088 -0.094115 0.442291
N 3.247571 0.235799 0.598575
C -1.076345 -0.838476 0.303094
C 1.418512 -1.439116 0.330580
C 0.347780 -0.425748 -0.140879
C -1.406575 -2.261041 -0.210691
C 1.078438 -2.864069 -0.176124
C -0.347618 -3.290804 0.246509
C -2.129798 0.201727 -0.149786
C 2.844139 -1.008616 -0.094358
C -4.684637 0.574941 -0.071621
C 4.383846 1.060315 0.094175
C -4.604033 2.122841 0.136454
C 5.713276 0.237154 0.097978
C -5.881610 0.013963 0.728946
C -4.871112 0.251685 -1.575715
C 4.076071 1.565250 -1.338042
C 4.528958 2.269356 1.046176
H -1.085424 -0.868358 1.417891
H 1.391440 -1.466080 1.444808
H 0.376429 -0.369029 -1.252005
H 0.609370 0.579724 0.240761
H -2.417860 -2.550479 0.128988
H -1.435146 -2.236071 -1.321800
H 1.151207 -2.880380 -1.284912
H 1.824821 -3.590722 0.204276
H -0.385212 -3.387434 1.351905
H -0.583433 -4.290414 -0.168020
H -2.222197 0.154035 -1.252046
H -1.743750 1.221404 0.096971
H 2.846085 -0.818419 -1.184804
H 3.539059 -1.866123 0.082753
H -3.422184 -0.074642 1.471198
H 3.306630 0.102096 1.617336
H -4.604529 2.355177 1.216487
H -3.664866 2.512439 -0.311271
H 5.569125 -0.709689 -0.464999
H 5.996210 -0.008172 1.137182
H -6.797960 0.581296 0.490506
H -5.703036 0.103957 1.818652
H -6.037771 -1.053559 0.494769
H -4.729378 -0.831148 -1.735576
H -5.891782 0.515045 -1.907514
H -4.148151 0.791831 -2.216826
H 4.134785 0.757807 -2.092982
H 4.783777 2.362467 -1.629104
H 3.056017 1.985583 -1.364672
H 3.645878 2.928051 0.972936
H 4.621002 1.933160 2.097982
H 5.437928 2.843934 0.797424
H -5.751607 2.808620 -1.380552
H 6.754654 1.103389 -1.403731


