%chk=000225948.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225948

0 1
O -0.826354 2.062607 -0.351154
O 2.800162 0.250623 1.181217
O -2.068754 0.745554 -1.699437
O 0.922257 -2.483939 0.919498
O 3.094931 -0.679412 -0.869289
O -1.879335 -0.903839 1.073769
O -1.798919 -2.516304 -0.525706
C 0.346621 0.290983 -1.347149
C 0.836272 -0.242809 0.017442
C 0.286259 -0.778039 -2.427902
C -1.001498 0.991140 -1.194240
C 0.281220 -1.595717 0.433559
C 2.361847 -0.286754 0.002039
C -1.245424 -1.765645 0.232118
C -2.009840 2.873409 -0.029833
C 4.246319 0.295360 1.428092
C -1.439742 4.166540 0.506943
C 4.873021 1.414607 0.626298
C -3.353438 -0.830101 0.969700
C -3.717952 0.271822 1.937273
H 1.075140 1.088109 -1.679714
H 0.511847 0.489786 0.827129
H 1.238765 -1.329818 -2.485727
H 0.104270 -0.340201 -3.418847
H -0.518986 -1.512034 -2.269627
H -2.612020 2.999246 -0.947082
H -2.582955 2.292086 0.726084
H 4.257393 0.474703 2.519265
H 4.669704 -0.695992 1.186884
H -2.234161 4.840091 0.850890
H -0.855332 4.698020 -0.257085
H -0.759770 3.986246 1.351801
H 4.851647 1.194159 -0.452125
H 4.345933 2.365713 0.775144
H 5.922485 1.568245 0.906687
H -3.751428 -1.820465 1.246299
H -3.592573 -0.595763 -0.085734
H -3.338909 0.063426 2.947963
H -3.282825 1.240131 1.625628
H -4.806080 0.395325 2.004628


%chk=000225948-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225948

0 1
O -1.569289 2.794143 -2.070642
O 2.326145 -0.977370 0.684296
O -2.086690 1.002734 -0.681114
O -0.071780 -1.541503 -1.426381
O 2.956571 1.105586 -0.157424
O -0.858508 -0.732938 1.969990
O -1.567674 -2.597302 0.762640
C 0.279117 1.493430 -1.227083
C 0.567324 0.441218 -0.116864
C 0.844960 1.166229 -2.636678
C -1.232566 1.709714 -1.276416
C -0.134276 -0.911495 -0.347652
C 2.072577 0.259095 0.101425
C -0.936905 -1.524186 0.826857
C -3.034351 3.076684 -2.226686
C 3.750811 -1.291038 1.031217
C -3.153048 4.252118 -3.189848
C 4.099733 -0.742295 2.416559
C -1.622782 -1.229387 3.158250
C -1.408853 -0.218398 4.278592
H 0.745505 2.444940 -0.904596
H 0.179471 0.836548 0.841789
H 1.943385 1.087477 -2.582147
H 0.589237 1.982229 -3.333007
H 0.440023 0.217076 -3.020528
H -3.521863 2.160750 -2.605624
H -3.448038 3.300683 -1.226861
H 3.784275 -2.391131 0.995762
H 4.400804 -0.863037 0.248361
H -4.218404 4.506872 -3.337007
H -2.717230 4.002646 -4.172145
H -2.634472 5.141843 -2.793944
H 4.064040 0.359997 2.423555
H 3.403538 -1.129853 3.180107
H 5.123797 -1.055400 2.692152
H -1.244285 -2.236489 3.410752
H -2.683095 -1.322663 2.862212
H -0.338757 -0.130087 4.533329
H -1.783807 0.777644 3.987779
H -1.954842 -0.543986 5.182723


