%chk=000266939.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266939

0 1
O 3.393849 -1.159443 -0.198174
O 3.861235 1.288081 -2.193976
O 5.102896 1.703748 -0.049070
O 3.719896 -1.528750 2.877047
N 1.203155 -0.711431 -0.950480
N -3.216717 -0.906531 0.843934
N -0.793593 -1.851760 -1.020557
N 0.555026 1.068086 0.689297
N -1.771593 0.877542 1.411402
C 2.636635 -0.455315 -1.189411
C 3.003870 1.044645 -1.073284
C 3.819183 1.172367 0.246757
C 3.912805 -0.258115 0.824694
C 3.120293 -0.473597 2.119626
C 0.327853 -0.050699 -0.072689
C -3.719537 -1.938596 -0.107872
C -4.328923 -0.206016 1.559192
C -4.660401 -1.308175 -1.147070
C -5.288467 0.456632 0.557935
C -5.813418 -0.556741 -0.467989
C -0.922578 -0.763698 -0.135723
C -2.007651 -0.274347 0.664164
C 0.455730 -1.822086 -1.480842
C -0.544508 1.463791 1.394775
H 2.945594 -0.912837 -2.163679
H 2.137726 1.738437 -1.121326
H 3.384054 1.914799 0.951540
H 4.968356 -0.595791 0.951222
H 2.059567 -0.710429 1.919817
H 3.188605 0.395188 2.802990
H -4.257654 -2.704858 0.495943
H -2.881067 -2.474301 -0.608762
H -3.922084 0.550060 2.270713
H -4.857881 -0.970490 2.170563
H -5.054858 -2.096853 -1.815038
H -4.087841 -0.618460 -1.798910
H -4.766978 1.286301 0.039234
H -6.130078 0.922246 1.104013
H -6.424543 -0.037392 -1.230450
H -6.492498 -1.277249 0.027461
H 0.901861 -2.519561 -2.176948
H 4.248603 2.197268 -2.118498
H 5.581414 1.118354 -0.691028
H 3.601324 -2.385404 2.410685
H -0.430762 2.365478 2.021569


%chk=000266939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266939

0 1
O 3.360695 -1.201674 0.042442
O 4.057417 0.945202 -2.255123
O 4.913803 2.076922 -0.016871
O 4.019359 -1.654601 2.784888
N 1.179476 -0.793234 -0.915407
N -3.336399 -0.700109 0.565306
N -0.873193 -1.772960 -1.190046
N 0.618962 0.884737 0.823502
N -1.748360 0.803632 1.453026
C 2.623689 -0.597540 -1.080898
C 3.072047 0.878127 -1.182234
C 3.740641 1.210121 0.196564
C 4.093208 -0.161183 0.821448
C 3.688060 -0.316546 2.292339
C 0.310853 -0.135655 -0.031671
C -3.812220 -1.794237 -0.316916
C -4.388226 -0.093539 1.418446
C -4.969329 -1.299075 -1.216573
C -5.550949 0.436710 0.548393
C -6.106524 -0.673701 -0.374951
C -0.962769 -0.750053 -0.215125
C -2.045997 -0.238456 0.586888
C 0.409968 -1.768225 -1.571946
C -0.484244 1.291525 1.524483
H 2.916844 -1.127459 -2.003454
H 2.222344 1.554356 -1.384683
H 3.028468 1.767156 0.822292
H 5.174269 -0.395010 0.705488
H 2.606059 -0.096142 2.392072
H 4.263460 0.382154 2.924451
H -4.179353 -2.619399 0.330076
H -2.971657 -2.173041 -0.917251
H -3.919853 0.705551 2.011374
H -4.765588 -0.876068 2.110318
H -5.347098 -2.152853 -1.810840
H -4.575036 -0.550391 -1.931277
H -5.184386 1.284764 -0.062276
H -6.346305 0.827500 1.211449
H -6.897547 -0.269041 -1.033913
H -6.578293 -1.463161 0.246957
H 0.843637 -2.434552 -2.314712
H 4.674599 1.690230 -2.006588
H 5.742798 1.558367 0.142127
H 3.568045 -2.307020 2.188877
H -0.329477 2.111969 2.232346


