%chk=000122835.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122835

0 1
 O   -1.354400      0.7265000      4.8400000E-02
 O    2.879800       2.814100     -0.2986000    
 O   0.3258000      -2.749800       1.434900    
 O   -7.582600      0.3534000     -0.5480000    
 C   -2.002200     -0.5374000     -0.1645000    
 C   -1.676900      -1.516700      0.9616000    
 C   0.6384000     -0.5504000      0.6361000    
 C   4.6000001E-03  0.6129000      0.1897000    
 C  -0.1845000      -1.713400       1.026900    
 C   -3.494100     -0.2996000     -0.2669000    
 C    2.784800      0.5334000      0.4325000    
 C    2.029900     -0.5958000      0.7522000    
 C   0.7634000       1.745200     -0.1092000    
 C    2.153100       1.702600      7.7000000E-03
 C    4.271900      0.4754000      0.5596000    
 C   -4.166200     -0.5908000      -1.453500    
 C   -4.194300      0.2111000      0.8254000    
 C    4.951200      1.6500000E-02 -0.7065000    
 C   -5.540400     -0.3707000      -1.547600    
 C   -5.568600      0.4310000      0.7312000    
 C   -6.241600      0.1401000     -0.4554000    
 C    5.714600      -1.077900     -0.8894000    
 C    3.136500       3.732500      0.7616000    
 C    6.363600      -1.476600      -2.184400    
 C    5.988400      -2.015700      0.2564000    
 H   -1.639200     -0.9408000      -1.121500    
 H   -2.154300      -2.485100      0.7746000    
 H   -1.991100      -1.150300       1.945400    
 H    2.526800      -1.498900       1.097000    
 H   0.2741000       2.656900     -0.4433000    
 H    4.682900       1.459600      0.8109000    
 H    4.534700     -0.1345000       1.429500    
 H   -3.634000     -0.9892000      -2.313000    
 H   -3.686500      0.4552000       1.754300    
 H    4.800400      0.6675000      -1.567500    
 H   -6.059300     -0.5995000      -2.474500    
 H   -6.103000      0.8316000       1.588500    
 H    3.428400       3.220500       1.684100    
 H    2.244600       4.339400      0.9456000    
 H    3.951600       4.393100      0.4536000    
 H    6.160700     -0.7487000      -2.976800    
 H    7.449400      -1.543700      -2.061900    
 H    5.986500      -2.448400      -2.518800    
 H    5.199000      -2.035500       1.010900    
 H    6.068200      -3.045700     -0.1105000    
 H    6.937000      -1.757100      0.7374000    
 H   -7.904200      0.7083000      0.2987000    


%chk=000122835-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122835

0 1
O -1.293294 0.630168 0.098996
O 3.182450 2.510411 0.328692
O 0.162470 -3.123882 1.336771
O -7.671502 0.650871 -0.467475
C -2.071855 -0.624525 -0.181803
C -1.765504 -1.677657 0.903290
C 0.618534 -0.824430 0.731092
C 0.071860 0.434480 0.348201
C -0.264174 -1.978238 0.998833
C -3.532420 -0.238927 -0.261131
C 2.880919 0.187072 0.802865
C 2.025171 -0.912240 0.937654
C 0.898431 1.569603 0.210986
C 2.285964 1.442760 0.439772
C 4.387127 0.073015 1.018530
C -4.352741 -0.745352 -1.299561
C -4.116676 0.593599 0.724609
C 5.158471 0.043913 -0.294686
C -5.728777 -0.447247 -1.352239
C -5.489216 0.911838 0.678786
C -6.296195 0.383114 -0.359233
C 5.957651 -0.953057 -0.771961
C 2.643983 3.834144 -0.002798
C 6.652871 -0.805774 -2.117942
C 6.239149 -2.264957 -0.060075
H -1.720361 -1.003318 -1.164535
H -2.313604 -2.613017 0.697379
H -2.113281 -1.302239 1.887175
H 2.424699 -1.889463 1.232002
H 0.436024 2.513189 -0.088217
H 4.730331 0.946827 1.606740
H 4.594167 -0.829110 1.619064
H -3.914341 -1.381137 -2.078438
H -3.487349 1.016210 1.514866
H 5.031586 0.946449 -0.909769
H -6.369655 -0.835920 -2.148678
H -5.927983 1.567038 1.442813
H 1.914950 4.169962 0.758914
H 2.166394 3.831656 -1.001041
H 3.515497 4.504552 -0.007910
H 6.419320 0.161500 -2.595640
H 7.753613 -0.879327 -2.008939
H 6.349196 -1.615311 -2.811843
H 5.716365 -2.358683 0.905345
H 5.936073 -3.122419 -0.693361
H 7.325024 -2.380555 0.129503
H -7.976464 1.239015 0.267297


