%chk=000239062.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239062

0 1
O -0.891089 2.182128 0.110286
O -0.327171 1.072000 -2.790477
O -6.778681 -2.213780 2.337352
O -8.167099 -1.533017 0.727040
N -2.423697 0.838717 -1.120188
C -1.095478 0.907805 -0.510059
C 1.374096 0.611124 -1.187439
C -0.009581 0.900554 -1.639106
C 4.005819 0.059752 -0.403584
C -3.535170 0.251224 -0.518603
C 2.202044 -0.172654 -2.007702
C 1.871548 1.134354 0.015206
C 3.508761 -0.456580 -1.611948
C 3.182600 0.862206 0.404399
C 5.394307 -0.237019 0.015035
C -1.603493 2.400961 1.365519
C -4.794403 0.374197 -1.168807
C -3.437627 -0.475099 0.694848
C -5.914858 -0.218212 -0.612167
C -4.572431 -1.063727 1.236533
C -5.818759 -0.939676 0.597343
C 6.292391 0.811977 0.267087
C 5.816149 -1.567959 0.160347
C -1.117409 3.766277 1.810736
C 7.602968 0.528288 0.659704
C 7.126682 -1.844239 0.558387
C 8.021285 -0.798226 0.807276
C -7.030857 -1.543765 1.149885
H -0.934621 0.081345 0.224366
H -2.550729 1.394671 -1.971702
H 1.817956 -0.553065 -2.957471
H 1.230880 1.771627 0.635735
H 4.151203 -1.067099 -2.246485
H 3.570458 1.268282 1.338227
H -2.688030 2.382255 1.157953
H -1.336842 1.596899 2.071321
H -4.876855 0.925731 -2.102600
H -2.480595 -0.589309 1.195264
H -6.890236 -0.132298 -1.103544
H -4.506913 -1.631164 2.171029
H 5.969168 1.845372 0.148272
H 5.120235 -2.383502 -0.031217
H -1.231921 4.504718 1.002558
H -0.052781 3.754921 2.075058
H -1.681755 4.127722 2.678234
H 8.300012 1.343122 0.850609
H 7.451661 -2.877301 0.674164
H 9.042563 -1.016392 1.115003
H -7.601710 -2.625647 2.710625


%chk=000239062-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239062

0 1
O -0.780068 2.226673 0.094758
O -0.416684 0.542668 -2.681094
O -7.158056 -1.799577 2.609684
O -8.263547 -1.735799 0.567025
N -2.421956 0.721153 -0.965810
C -1.119788 0.858489 -0.371759
C 1.369810 0.395270 -1.066606
C -0.043441 0.592405 -1.471343
C 4.113944 -0.058709 -0.381804
C -3.567275 0.179831 -0.378970
C 2.312178 0.004548 -2.059434
C 1.819360 0.565291 0.271829
C 3.655594 -0.218275 -1.722696
C 3.166728 0.341002 0.603783
C 5.539280 -0.300919 -0.025960
C -1.676528 2.744584 1.153346
C -4.713697 -0.045686 -1.204285
C -3.649923 -0.158101 1.006937
C -5.886484 -0.588353 -0.667382
C -4.827731 -0.710479 1.534755
C -5.962569 -0.932538 0.711166
C 6.172431 0.440736 1.010525
C 6.306064 -1.281306 -0.716383
C -1.216860 4.166263 1.470968
C 7.523806 0.211672 1.343610
C 7.656523 -1.512925 -0.381934
C 8.273010 -0.767061 0.649546
C -7.218592 -1.505104 1.229567
H -1.009289 0.149075 0.475957
H -2.419297 0.864990 -1.983521
H 1.961969 -0.110050 -3.090474
H 1.119459 0.901087 1.042353
H 4.369219 -0.490541 -2.507611
H 3.488156 0.451594 1.644948
H -2.723230 2.731026 0.791453
H -1.606208 2.089357 2.050340
H -4.664101 0.207962 -2.269949
H -2.799254 0.012382 1.672953
H -6.763869 -0.761814 -1.299120
H -4.884740 -0.971212 2.595510
H 5.614446 1.224758 1.534617
H 5.833369 -1.888556 -1.496477
H -1.285317 4.802533 0.572224
H -0.169573 4.171686 1.819485
H -1.853114 4.604495 2.261429
H 7.995199 0.802261 2.136875
H 8.225237 -2.279889 -0.919114
H 9.322306 -0.945537 0.908650
H -8.034903 -2.182861 2.879736


