%chk=000261304.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261304

0 1
O -0.108609 -1.260779 1.906446
O 2.783179 -0.756130 -0.113989
N -1.400572 -0.211266 -0.500442
C -0.131562 -1.003433 -0.536129
C -1.406405 0.901795 -1.504482
C -2.601313 -1.098336 -0.655534
C 0.616122 -0.719650 0.784073
C -0.415002 2.011510 -1.116681
C -3.874037 -0.387502 -0.162689
C -0.842358 2.750483 0.158595
C -3.838964 -0.110774 1.346264
C 1.966430 -1.454074 0.854643
C 0.173481 3.815838 0.563062
C -5.129520 0.544178 1.832438
C 4.181926 -1.140478 -0.067079
C 4.823195 -0.308696 -1.136083
C 6.116797 -0.380575 -1.436680
H -0.316565 -2.093412 -0.630640
H 0.533840 -0.732179 -1.385848
H -2.436788 1.326981 -1.535160
H -1.180483 0.546446 -2.533332
H -2.437549 -2.016385 -0.047281
H -2.749806 -1.437944 -1.703445
H 0.745333 0.374935 0.948137
H -0.333886 2.727399 -1.957237
H 0.602135 1.592025 -0.983548
H -4.752396 -1.012722 -0.413188
H -4.011750 0.566737 -0.710646
H -0.973462 2.017816 0.981679
H -1.837194 3.212705 0.011535
H -2.972851 0.544250 1.576117
H -3.665019 -1.053455 1.899961
H 2.403028 -1.370992 1.865411
H 1.890535 -2.516313 0.571551
H 0.302588 4.571285 -0.219588
H 1.158772 3.377829 0.761344
H -0.141616 4.336462 1.474120
H -6.002132 -0.091990 1.647555
H -5.309281 1.502430 1.332153
H -5.090088 0.741047 2.909872
H -1.035721 -0.925698 1.879058
H 4.584205 -0.914165 0.938182
H 4.264826 -2.224313 -0.268902
H 4.129763 0.366331 -1.647611
H 6.575943 0.222538 -2.207235
H 6.818231 -1.038259 -0.945044


%chk=000261304-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261304

0 1
O 0.002145 -0.081588 1.833409
O 3.070249 -0.708965 -0.114819
N -1.247229 0.047641 -0.495517
C 0.184989 -0.379480 -0.591978
C -1.571618 1.235289 -1.337750
C -2.201204 -1.084390 -0.711085
C 0.934463 0.038195 0.712958
C -0.798897 2.520213 -0.970721
C -3.648900 -0.804194 -0.248926
C -1.124991 3.093609 0.427918
C -3.776839 -0.407443 1.238932
C 2.136615 -0.857832 1.011628
C -0.391217 4.424460 0.700375
C -5.247456 -0.275100 1.688970
C 4.280158 -1.529660 0.054635
C 5.238789 -1.184964 -1.055292
C 5.874600 -2.096423 -1.831316
H 0.225787 -1.481449 -0.681599
H 0.689328 0.040916 -1.482302
H -2.652577 1.440567 -1.230801
H -1.390970 0.996206 -2.415679
H -1.814617 -1.944947 -0.133434
H -2.215337 -1.389157 -1.787112
H 1.290866 1.086569 0.617961
H -1.048491 3.281744 -1.738797
H 0.292870 2.350018 -1.057996
H -4.231379 -1.731227 -0.430313
H -4.121005 -0.025983 -0.881628
H -0.854422 2.357330 1.207924
H -2.220749 3.249924 0.508271
H -3.247775 0.549759 1.412440
H -3.261773 -1.165107 1.863997
H 2.618313 -0.545322 1.962879
H 1.804349 -1.914576 1.115616
H -0.668581 5.195152 -0.044175
H 0.705818 4.288498 0.649473
H -0.633931 4.819486 1.703699
H -5.789760 -1.231901 1.565136
H -5.779175 0.490239 1.091836
H -5.318595 0.017996 2.752342
H -0.887060 0.093164 1.374239
H 4.738444 -1.297872 1.045086
H 4.023807 -2.611538 0.041234
H 5.418803 -0.110135 -1.195542
H 6.590197 -1.792558 -2.603112
H 5.699360 -3.173666 -1.717362


