%chk=000216122.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216122

0 1
O -0.570710 1.032567 -1.571523
O -0.339748 -1.085861 -2.335592
N -3.975823 0.114609 -0.382933
C 2.470340 0.026620 -0.695293
C 1.616142 0.324634 -1.942479
C 2.661696 -0.774130 -1.974729
C 1.845387 -0.616134 0.503963
C 3.505144 1.039745 -0.307895
C 0.174762 -0.051018 -1.985108
C 0.774738 0.013398 1.155904
C 4.837270 0.641683 -0.126146
C 2.351366 -1.827463 0.995763
C 3.138881 2.378272 -0.106360
C -5.997362 0.279415 1.052581
C -2.026773 0.914298 -1.592138
C -4.467633 0.046727 1.032060
C -2.483354 0.010975 -0.438726
C -6.707009 -0.780153 0.187848
C -4.613726 -0.950785 -1.226665
C -6.138519 -0.756426 -1.235452
C 0.214482 -0.568872 2.295221
C 5.798993 1.583098 0.250742
C 1.784425 -2.406127 2.134946
C 4.105650 3.314352 0.270017
C 0.717703 -1.778485 2.786029
C 5.435654 2.919241 0.447876
C -6.514274 0.252080 2.493658
H 1.810838 1.267916 -2.478282
H 2.327430 -1.813706 -2.012798
H 3.558793 -0.633446 -2.575646
H 0.381425 0.954082 0.765170
H 5.119360 -0.399086 -0.273933
H 3.183966 -2.315298 0.492334
H 2.101833 2.685050 -0.239985
H -6.200580 1.288205 0.613197
H -2.335324 1.967213 -1.459889
H -2.339385 0.536904 -2.579343
H -3.965411 0.853081 1.607838
H -4.220722 -0.914384 1.529592
H -2.020728 0.362782 0.508045
H -2.105562 -1.024825 -0.595532
H -6.582796 -1.784661 0.632826
H -7.794888 -0.587701 0.167138
H -4.363380 -1.977738 -0.883001
H -4.216850 -0.851859 -2.260229
H -6.609140 -1.543334 -1.852351
H -6.383961 0.209795 -1.720253
H -0.612826 -0.077925 2.804570
H 6.833333 1.274057 0.392495
H 2.175948 -3.347991 2.515798
H 3.821223 4.353759 0.426527
H 0.280183 -2.230290 3.674078
H 6.186427 3.650354 0.741307
H -6.333970 -0.714336 2.976565
H -7.593821 0.436869 2.529463
H -6.033621 1.021952 3.106932


%chk=000216122-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216122

0 1
O -0.760009 1.264026 -1.870764
O -0.297488 -1.028849 -1.958792
N -4.065430 0.275999 -0.319278
C 2.488895 0.085236 -0.776787
C 1.519523 0.616124 -1.890083
C 2.623358 -0.401369 -2.216544
C 1.956736 -0.853058 0.291331
C 3.513098 1.083374 -0.261920
C 0.104190 0.158982 -1.913378
C 1.183570 -0.331449 1.360725
C 4.844797 0.654359 -0.027067
C 2.255657 -2.236336 0.277598
C 3.163472 2.422715 0.041217
C -6.344067 0.413867 0.709769
C -2.218310 0.948073 -1.815927
C -4.844379 0.770312 0.841780
C -2.665230 0.755243 -0.353024
C -6.503006 -1.116662 0.529085
C -4.165405 -1.200916 -0.452471
C -5.632466 -1.633242 -0.638906
C 0.713387 -1.176292 2.388193
C 5.807197 1.545982 0.493753
C 1.790377 -3.084769 1.307451
C 4.125137 3.317537 0.563343
C 1.016837 -2.558245 2.366283
C 5.450176 2.882482 0.792185
C -7.141725 0.933441 1.923722
H 1.667336 1.656067 -2.190396
H 2.269586 -1.410020 -2.451175
H 3.470387 -0.042209 -2.807780
H 0.954752 0.740807 1.388692
H 5.122205 -0.382507 -0.251746
H 2.847616 -2.652827 -0.545225
H 2.137687 2.767864 -0.135442
H -6.715922 0.908658 -0.211173
H -2.712900 1.816585 -2.275507
H -2.409115 0.037991 -2.409358
H -4.727425 1.869477 0.899048
H -4.460989 0.342384 1.807895
H -2.600364 1.724480 0.174447
H -1.962462 0.052198 0.153988
H -6.195084 -1.621556 1.469904
H -7.568234 -1.369423 0.362720
H -3.743607 -1.706595 0.456249
H -3.553573 -1.527076 -1.312458
H -5.684861 -2.737230 -0.703650
H -6.008025 -1.222303 -1.595931
H 0.114759 -0.759650 3.206328
H 6.832761 1.201030 0.667861
H 2.027711 -4.154329 1.281314
H 3.840567 4.351106 0.790978
H 0.653924 -3.215837 3.164254
H 6.196558 3.575423 1.196469
H -6.781156 0.468188 2.861800
H -8.216591 0.693762 1.822584
H -7.048939 2.030674 2.032021


