%chk=000179626.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179626

0 1
O -1.144371 -1.828790 -0.994904
O 1.577187 0.721094 -0.001175
O 5.299418 0.760140 -1.874452
O 0.812905 1.982411 1.709144
C -3.856332 1.593488 -0.883351
C -2.681473 2.562528 -1.110284
C -4.053841 -0.875773 -0.380860
C -3.479371 -2.273361 -0.523363
C -3.427136 0.161762 -0.953823
C -2.073477 -2.325422 -0.062570
C -1.613682 2.389995 -0.058694
C -5.316137 -0.786876 0.411931
C -1.434033 -2.710102 1.086529
C -0.025169 -2.429352 0.895930
C -1.936697 2.916714 1.294804
C -0.451783 1.774004 -0.363301
C 0.105873 -1.897192 -0.362980
C 1.046492 -2.671219 1.883641
C 0.635599 1.560551 0.584697
C 2.744990 0.364773 0.799116
C 3.927907 0.459658 -0.087960
C 5.290191 0.197292 0.329472
C 3.977658 0.793841 -1.418211
C 6.078029 0.389182 -0.772967
H -4.337260 1.814103 0.092676
H -4.634632 1.781192 -1.654248
H -3.053947 3.607453 -1.103267
H -2.265859 2.409709 -2.128439
H -4.082922 -3.017274 0.039890
H -3.543720 -2.588748 -1.591025
H -2.501801 -0.010167 -1.517242
H -5.174116 -1.183665 1.427610
H -5.679028 0.243583 0.519196
H -6.123610 -1.364610 -0.058730
H -1.862157 -3.128741 1.973278
H -1.028189 3.186271 1.869581
H -2.587158 3.797797 1.275988
H -2.444034 2.142801 1.894969
H -0.269057 1.360237 -1.359662
H 0.900143 -1.499005 -0.953355
H 1.399134 -3.712458 1.841470
H 1.919617 -2.015173 1.705648
H 0.700885 -2.483531 2.910394
H 2.821579 1.037830 1.680215
H 2.545967 -0.679631 1.139233
H 5.590902 -0.086185 1.318464
H 3.267626 1.068520 -2.165124
H 7.119095 0.327948 -0.996688


%chk=000179626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179626

0 1
O -0.575906 -1.572681 -0.672368
O 1.301954 1.435626 0.052984
O 4.764113 -0.345950 -1.523162
O 0.247578 2.576065 1.789920
C -4.258137 1.677775 -1.040937
C -3.137176 2.745136 -1.318750
C -3.497403 -0.686978 -0.318043
C -3.005021 -2.071840 -0.758922
C -3.779293 0.258491 -1.258371
C -1.630589 -2.419174 -0.258964
C -2.096652 2.816024 -0.211567
C -3.624854 -0.495860 1.180366
C -1.114247 -3.417616 0.551341
C 0.322435 -3.208810 0.663988
C -2.496710 3.608219 1.015354
C -0.893473 2.175893 -0.370363
C 0.603720 -2.081526 -0.089076
C 1.304191 -4.047678 1.441129
C 0.198492 2.120743 0.615477
C 2.467197 1.279254 0.954504
C 3.552307 0.595244 0.174891
C 4.830859 0.150520 0.704399
C 3.550037 0.277451 -1.172138
C 5.532124 -0.409387 -0.347945
H -4.658954 1.820891 -0.021036
H -5.092438 1.890088 -1.739064
H -3.626009 3.734890 -1.422053
H -2.659266 2.505733 -2.286787
H -3.692238 -2.853823 -0.378637
H -3.027918 -2.130909 -1.864697
H -3.616349 -0.012612 -2.313922
H -2.643515 -0.637979 1.671995
H -3.996101 0.504076 1.455936
H -4.310939 -1.249604 1.615895
H -1.687843 -4.216380 1.020594
H -1.793389 3.471336 1.848755
H -2.536755 4.687489 0.764280
H -3.517151 3.327963 1.341071
H -0.691568 1.628268 -1.296871
H 1.513722 -1.528805 -0.308436
H 1.317091 -5.092593 1.078017
H 2.329522 -3.649072 1.351750
H 1.046356 -4.078659 2.516548
H 2.780478 2.277408 1.316141
H 2.159199 0.691840 1.840779
H 5.177470 0.240651 1.732778
H 2.830273 0.417356 -1.971368
H 6.510985 -0.868893 -0.448215


