%chk=000186575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186575

0 1
O -5.566318 0.437810 0.128085
O -3.872546 -1.974847 0.076300
C -4.256992 0.273108 -0.449688
C -3.431976 -0.662129 0.473630
C -3.702369 1.699701 -0.551634
C -1.947752 -0.461658 0.299788
C -2.515827 1.976515 0.381302
C -1.485073 0.888022 0.282334
C -0.133973 1.151924 0.170493
C 0.809673 0.094494 0.063813
C -1.050240 -1.500947 0.176030
C 0.341994 -1.240413 0.058778
C 2.240633 0.349140 -0.047145
C 1.283107 -2.332123 -0.065509
C 3.132257 -0.743782 -0.163587
C 2.614970 -2.095310 -0.171756
C 2.773603 1.666592 -0.041665
C 4.528917 -0.504826 -0.271893
C 4.133574 1.880801 -0.147617
C 5.020793 0.785028 -0.263970
H -4.373807 -0.204172 -1.449745
H -3.721758 -0.508965 1.541564
H -4.530235 2.408678 -0.323141
H -3.406378 1.902162 -1.599477
H -2.870873 2.050361 1.432746
H -2.083249 2.968704 0.144934
H 0.225506 2.181739 0.157760
H -1.397673 -2.533675 0.153778
H 0.887578 -3.347408 -0.072767
H -6.023492 -0.430065 0.172718
H -3.445326 -2.662823 0.623522
H 3.328910 -2.912959 -0.266385
H 2.091544 2.513430 0.047686
H 5.205496 -1.353523 -0.361407
H 4.535857 2.892525 -0.142842
H 6.090246 0.971791 -0.346833


%chk=000186575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186575

0 1
O -5.662116 0.234225 -0.228809
O -3.950148 -1.993166 0.293341
C -4.223786 0.246218 -0.531148
C -3.467535 -0.617608 0.505041
C -3.748428 1.722279 -0.522897
C -1.968761 -0.440131 0.350092
C -2.567814 1.994883 0.458697
C -1.503658 0.916763 0.348286
C -0.134278 1.176261 0.216608
C 0.824191 0.123549 0.081545
C -1.062478 -1.488708 0.191753
C 0.338499 -1.235423 0.061004
C 2.263831 0.368860 -0.048574
C 1.269736 -2.329516 -0.097846
C 3.157783 -0.754518 -0.202853
C 2.625546 -2.098761 -0.225306
C 2.833977 1.679848 -0.029071
C 4.563672 -0.529698 -0.332706
C 4.215534 1.878696 -0.157696
C 5.091909 0.766007 -0.311987
H -4.043361 -0.222739 -1.521273
H -3.784383 -0.270113 1.514707
H -4.619232 2.342105 -0.245656
H -3.442779 2.014694 -1.542465
H -2.965686 2.022857 1.494675
H -2.139426 2.993373 0.259557
H 0.195921 2.220350 0.209930
H -1.422259 -2.522933 0.142340
H 0.873913 -3.351842 -0.116933
H -5.937389 -0.719024 -0.183160
H -3.716777 -2.552002 1.075843
H 3.325510 -2.933969 -0.346294
H 2.188054 2.555137 0.090399
H 5.226324 -1.395672 -0.449811
H 4.624057 2.895061 -0.138676
H 6.170636 0.927558 -0.412456


