%chk=000181105.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181105

0 1
O -2.603862 1.600138 -0.177452
O 0.026161 3.023560 -0.183974
C 2.233844 -1.356146 0.176444
C 0.961469 -0.526636 0.137145
C 3.438233 -0.547858 0.694753
C 1.056391 0.885120 0.031425
C 3.598366 0.760806 -0.082096
C 2.355598 1.638182 0.080838
C -0.284372 -1.181926 0.180363
C -1.456754 -0.410541 0.063038
C 2.511975 -1.935173 -1.219222
C -0.113383 1.656468 -0.078410
C -1.346138 0.995865 -0.069558
C -2.892515 -0.681160 0.030347
C -0.401961 -2.662081 0.349655
C -3.519731 0.526131 -0.111502
C -3.544393 -2.003382 0.122033
H 2.075074 -2.214143 0.885432
H 4.359576 -1.153575 0.619775
H 3.298842 -0.330432 1.771574
H 3.769430 0.543355 -1.154988
H 4.494389 1.308094 0.265120
H 2.348306 2.437232 -0.693613
H 2.398536 2.182047 1.051202
H 1.673109 -2.542488 -1.575373
H 2.664924 -1.136465 -1.955757
H 3.407659 -2.563299 -1.219995
H -1.196361 -2.921456 1.063494
H -0.642345 -3.147962 -0.606417
H 0.525556 -3.119894 0.727344
H -4.529679 0.859748 -0.185476
H -4.638604 -1.936523 0.048223
H -3.202466 -2.670587 -0.684314
H -3.311162 -2.496716 1.078432
H -0.863610 3.455295 -0.271091


%chk=000181105-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181105

0 1
O -2.602631 1.625187 -0.131699
O -0.032498 3.078469 -0.132222
C 2.280607 -1.344836 0.202870
C 0.978700 -0.525884 0.144903
C 3.492042 -0.501907 0.677421
C 1.065789 0.907425 0.045160
C 3.628073 0.798028 -0.138105
C 2.382484 1.679063 0.073568
C -0.282626 -1.201446 0.166408
C -1.465607 -0.408484 0.069050
C 2.572055 -2.024456 -1.166421
C -0.117585 1.675287 -0.044733
C -1.340475 0.996724 -0.038565
C -2.915557 -0.673422 0.039019
C -0.401950 -2.715825 0.269550
C -3.535765 0.553283 -0.081515
C -3.642841 -1.992630 0.119162
H 2.147777 -2.156870 0.945703
H 4.411319 -1.114148 0.596659
H 3.365488 -0.242131 1.748182
H 3.749011 0.557265 -1.211694
H 4.533670 1.356293 0.165866
H 2.340425 2.491718 -0.674991
H 2.459047 2.193965 1.054214
H 1.738960 -2.679297 -1.476265
H 2.713108 -1.272444 -1.963089
H 3.489164 -2.640892 -1.106593
H -1.246164 -3.004785 0.917436
H -0.579475 -3.178799 -0.721529
H 0.505074 -3.183614 0.684330
H -4.579958 0.847722 -0.146670
H -4.725653 -1.854349 -0.045965
H -3.274581 -2.706276 -0.639386
H -3.517212 -2.469212 1.109385
H -0.942116 3.464875 -0.202046


