%chk=000197699.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197699

0 1
O -1.485380 -1.495747 1.008968
O 2.807056 3.309433 0.734690
O -4.594788 3.005972 0.450950
C 3.020406 0.411970 -1.485749
C 2.445427 -0.651953 -0.489980
C 0.914949 -0.824026 -0.613683
C 2.510799 1.813415 -1.088229
C 2.770729 -0.260316 0.939700
C 0.448964 -2.216804 -0.177749
C 4.559728 0.379431 -1.423658
C 2.587669 0.096015 -2.927946
C -1.087827 -2.341018 -0.140189
C 2.745824 2.152056 0.370979
C 2.883290 1.025448 1.313799
C 2.938701 -1.384332 1.907019
C -1.539846 -3.733775 0.302680
C -1.726688 -1.954939 -1.446922
C -2.259368 -0.382621 0.812411
C -2.524303 -0.888288 -1.584717
C -2.807443 -0.028322 -0.439726
C -2.481776 0.388589 1.970125
C -3.595031 1.126503 -0.530449
C -3.263241 1.534122 1.875267
C -3.807784 1.885944 0.625739
H 2.935844 -1.626072 -0.732765
H 0.394570 -0.052805 -0.006906
H 0.596073 -0.637594 -1.661307
H 1.423822 1.904304 -1.290708
H 2.979765 2.592687 -1.722015
H 0.866890 -2.992094 -0.845642
H 0.843525 -2.436768 0.842276
H 4.935221 0.616642 -0.421381
H 4.958302 -0.600712 -1.700937
H 4.999615 1.113927 -2.107606
H 2.957290 0.852280 -3.628949
H 2.974827 -0.872484 -3.260646
H 1.494681 0.063332 -3.028232
H 3.089478 1.322246 2.341919
H 2.065731 -2.064208 1.874883
H 3.040066 -1.041915 2.946233
H 3.831096 -1.982065 1.675419
H -2.635051 -3.814777 0.283125
H -1.131784 -4.523698 -0.333751
H -1.233770 -3.932982 1.338468
H -1.491322 -2.617935 -2.277288
H -2.987230 -0.623063 -2.535673
H -2.038305 0.077932 2.914594
H -4.039217 1.440767 -1.472997
H -3.446646 2.148362 2.752973
H -4.687838 3.521834 1.286781


%chk=000197699-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000197699

0 1
O -1.700781 -1.331483 1.223855
O 3.352343 2.592020 2.010098
O -4.427745 3.038045 -1.061118
C 2.651386 0.813351 -1.221391
C 2.349215 -0.599906 -0.588260
C 0.822636 -0.809019 -0.309250
C 2.416370 1.911869 -0.143167
C 3.180078 -0.804390 0.681847
C 0.438938 -2.170974 0.304822
C 4.128550 0.850477 -1.705733
C 1.744906 1.099021 -2.446825
C -1.099026 -2.426454 0.372822
C 3.094990 1.643480 1.204241
C 3.453623 0.247102 1.520408
C 3.734072 -2.184958 0.957394
C -1.393830 -3.717447 1.162318
C -1.728421 -2.479472 -1.011339
C -2.350974 -0.242098 0.620367
C -2.491698 -1.475188 -1.524381
C -2.775172 -0.269437 -0.740633
C -2.629744 0.873101 1.434173
C -3.468472 0.844558 -1.269462
C -3.322162 1.981683 0.896637
C -3.736998 1.966114 -0.457651
H 2.654440 -1.372177 -1.328545
H 0.461878 -0.009332 0.362333
H 0.285778 -0.699110 -1.268825
H 1.330363 2.022153 0.055236
H 2.761482 2.898805 -0.504140
H 0.888990 -2.996331 -0.287058
H 0.827442 -2.251677 1.337926
H 4.841612 0.653358 -0.886443
H 4.296825 0.095842 -2.497759
H 4.369306 1.842918 -2.129884
H 2.069657 2.031702 -2.944809
H 1.809436 0.281594 -3.190835
H 0.684493 1.227300 -2.166879
H 4.016837 0.098872 2.450453
H 2.956642 -2.967068 0.895700
H 4.218308 -2.245688 1.946920
H 4.491987 -2.441334 0.189050
H -2.479858 -3.902863 1.207451
H -0.905574 -4.586165 0.684004
H -1.012318 -3.621294 2.193555
H -1.524855 -3.388524 -1.590526
H -2.916367 -1.554243 -2.532177
H -2.304586 0.866020 2.478513
H -3.806245 0.848025 -2.311138
H -3.531539 2.850242 1.534068
H -4.570521 3.770878 -0.412764


