%chk=000297178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297178

0 1
O -0.642689 0.603708 0.468176
O 0.159582 -0.345858 2.365783
O 1.559647 -0.942558 -2.584048
O 0.612696 -1.898511 -0.799900
C -2.400060 -0.988858 -0.127186
C -3.760123 0.699923 -0.822174
C -2.720413 -0.264462 -1.465411
C -2.024808 0.209463 0.792598
C -2.907413 1.375107 0.290460
C -3.810150 -1.456876 0.325250
C -4.738933 -0.301205 -0.142520
C 0.358496 0.183988 1.300038
C 1.677942 0.558385 0.695982
C 2.137378 -0.005047 -0.506210
C 2.463437 1.496231 1.376130
C 3.377771 0.389531 -1.029633
C 3.703185 1.878544 0.852588
C 4.157807 1.329063 -0.349537
C 1.343855 -1.035270 -1.224450
H -1.632246 -1.773829 -0.173159
H -4.243274 1.408980 -1.502012
H -3.140252 -0.922546 -2.233394
H -1.851635 0.247821 -1.898095
H -2.091423 0.000290 1.873841
H -2.284878 2.189394 -0.119637
H -3.519094 1.809597 1.091985
H -3.867537 -1.625221 1.410010
H -4.077118 -2.410153 -0.155397
H -5.496059 -0.658373 -0.855758
H -5.282141 0.156028 0.695693
H 2.109643 1.923398 2.317122
H 3.724188 -0.038605 -1.974731
H 4.314252 2.608072 1.386222
H 5.121708 1.632270 -0.759613
H 1.042558 -1.625022 -3.093213


%chk=000297178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297178

0 1
O -0.630644 0.653278 0.291452
O 0.119096 -0.392668 2.244997
O 1.810499 -0.528924 -2.924071
O 0.536014 -1.506125 -1.251090
C -2.504738 -1.015868 0.091090
C -3.869961 0.483225 -0.963960
C -2.872734 -0.640105 -1.372523
C -2.057946 0.353875 0.666704
C -2.961361 1.385095 -0.072299
C -3.908940 -1.309371 0.707061
C -4.854573 -0.290200 -0.034097
C 0.348765 0.159896 1.142289
C 1.729779 0.495969 0.643942
C 2.203790 0.194295 -0.666015
C 2.580654 1.173952 1.548773
C 3.496099 0.627404 -1.060139
C 3.869903 1.590947 1.152556
C 4.323529 1.329696 -0.160499
C 1.417546 -0.680120 -1.582548
H -1.761606 -1.812979 0.232233
H -4.360273 1.029486 -1.786119
H -3.350090 -1.471045 -1.921744
H -2.005460 -0.272804 -1.946884
H -2.118404 0.382915 1.768162
H -2.327553 2.047565 -0.688146
H -3.538678 2.014494 0.627216
H -3.917484 -1.179871 1.804901
H -4.203168 -2.353192 0.498196
H -5.623015 -0.817389 -0.628177
H -5.380334 0.387275 0.663369
H 2.217144 1.375133 2.561343
H 3.843521 0.388949 -2.068823
H 4.513598 2.118932 1.864018
H 5.320055 1.655832 -0.475761
H 1.290866 -1.170154 -3.479607


