%chk=000180227.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180227

0 1
O 1.104502 -2.939919 -0.532635
O 3.987029 1.001990 0.417361
C -0.422589 0.319257 -0.901126
C -2.657235 0.055547 0.510378
C -1.364174 -0.528134 -0.021522
C -0.238938 1.712975 -0.279127
C 0.898289 -0.538145 -0.960486
C -2.395628 1.497142 1.025030
C -1.590198 2.359277 0.047838
C -0.989625 0.426112 -2.324657
C -0.871386 -1.759396 0.196070
C 0.464617 -1.926453 -0.424563
C -3.710879 0.055642 -0.612127
C -3.189667 -0.785301 1.688176
C 2.031425 -0.008802 -0.164550
C 2.207597 -0.127381 1.269802
C 3.126704 0.676030 -0.636522
C 3.390772 0.488818 1.573043
H 0.346002 2.358480 -0.959625
H 0.362441 1.638878 0.650379
H 1.227652 -0.661790 -2.021044
H -1.856159 1.443035 1.991546
H -3.362144 1.986294 1.247747
H -1.424367 3.361752 0.488309
H -2.169354 2.532088 -0.879459
H -0.326846 1.005280 -2.976165
H -1.132446 -0.559814 -2.781930
H -1.970318 0.926777 -2.326134
H -1.314549 -2.573567 0.744629
H -3.401147 0.688402 -1.456234
H -3.878761 -0.954591 -1.002032
H -4.673575 0.433472 -0.252754
H -2.441548 -0.891745 2.481421
H -4.079965 -0.328664 2.133045
H -3.471620 -1.794597 1.367561
H 1.525557 -0.623230 1.933496
H 3.478466 1.006665 -1.585815
H 3.962567 0.669118 2.455377


%chk=000180227-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180227

0 1
O 1.127623 -2.989746 -0.601327
O 4.071576 0.920763 0.466811
C -0.419606 0.345214 -0.931613
C -2.670198 0.045972 0.523565
C -1.368634 -0.510479 -0.056339
C -0.271464 1.772845 -0.333497
C 0.911450 -0.519500 -0.970683
C -2.408065 1.507645 1.026723
C -1.642542 2.394729 0.019811
C -0.944386 0.438575 -2.400588
C -0.873375 -1.775585 0.131739
C 0.454625 -1.929432 -0.491643
C -3.806841 0.045589 -0.549747
C -3.157682 -0.812655 1.721144
C 2.065024 -0.021045 -0.127971
C 2.207908 -0.085805 1.320166
C 3.213049 0.592831 -0.599440
C 3.423769 0.487663 1.638709
H 0.278081 2.416586 -1.047526
H 0.342327 1.728103 0.585710
H 1.270412 -0.608773 -2.012357
H -1.820872 1.454829 1.966867
H -3.383373 1.966292 1.284085
H -1.485486 3.396784 0.463268
H -2.248135 2.554128 -0.893388
H -0.196550 0.963662 -3.023472
H -1.104470 -0.568583 -2.826792
H -1.891740 0.995583 -2.479162
H -1.356288 -2.594414 0.669457
H -3.626993 0.765627 -1.364510
H -3.925425 -0.957120 -0.998317
H -4.762085 0.319985 -0.064249
H -2.368070 -0.922113 2.486526
H -4.031630 -0.329405 2.196231
H -3.469261 -1.823061 1.399118
H 1.503004 -0.528152 2.022198
H 3.578486 0.845945 -1.590762
H 3.966339 0.658019 2.563956


