%chk=000157992.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157992

0 1
 O    2.682700       1.284200       1.257500    
 O   -4.995200     -0.4640000       1.481000    
 O    5.578500     -0.4321000      0.4329000    
 C   -1.201700     -0.7190000     -0.2652000    
 C   0.3165000     -0.5399000      0.1781000    
 C   -1.914200      0.6643000     -4.5299999E-02
 C   -3.484800      0.6879000     -3.6300000E-02
 C   0.9491000      0.7532000     -0.3238000    
 C   -1.871400      -1.775700      0.6484000    
 C    1.199300      -1.754100     -0.1906000    
 C    3.284500     -0.3173000     -0.3514000    
 C    2.433100      0.9360000     -0.1198000    
 C   -1.277600       1.730200     -0.9643000    
 C    2.647100      -1.574600      0.2580000    
 C   -1.272400      -1.203200      -1.734900    
 C   0.2198000       1.738600     -0.8772000    
 C   -3.375000      -1.867200      0.4546000    
 C   -4.019700     -0.5317000      0.7307000    
 C    4.464800      7.0299998E-02  0.5042000    
 C   -3.958300       1.962300      0.7099000    
 C   -4.163000      0.7042000      -1.415200    
 C    3.663900     -0.4952000      -1.817700    
 C    4.093800       1.143200       1.486400    
 H   0.3285000     -0.4610000       1.276000    
 H   -1.637200      0.9499000      0.9844000    
 H   -1.671100      -1.527300       1.699400    
 H   -1.438000      -2.767500      0.4762000    
 H    1.197200      -1.929100      -1.271600    
 H   0.8053000      -2.662200      0.2783000    
 H    2.804600       1.771800     -0.7306000    
 H   -1.629100       2.725700     -0.6731000    
 H   -1.563000       1.584800      -2.011200    
 H    2.673100      -1.533700       1.355500    
 H    3.228600      -2.463600     -1.7999999E-02
 H   -2.284800      -1.207000      -2.132700    
 H  -0.6630000     -0.5893000      -2.405100    
 H  -0.9177000      -2.235800      -1.829200    
 H   0.7123000       2.640600      -1.231900    
 H   -3.784200      -2.602000       1.157500    
 H   -3.646400      -2.196100     -0.5524000    
 H   -5.051100       1.994700      0.7978000    
 H   -3.654300       2.876200      0.1904000    
 H   -3.555900       1.998500       1.728900    
 H   -3.824900       1.543600      -2.030100    
 H   -5.250400      0.8071000      -1.306500    
 H   -4.015200     -0.2182000      -1.976800    
 H    2.780800     -0.6093000      -2.454300    
 H    4.232700      0.3660000      -2.187100    
 H    4.298300      -1.378000      -1.955800    
 H    4.262500      0.8256000       2.516200    
 H    4.600900       2.081200       1.249900    


%chk=000157992-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000157992

0 1
O 2.653275 1.346072 1.263942
O -5.012921 -0.464676 1.560771
O 5.685741 -0.431155 0.427948
C -1.205436 -0.720880 -0.290524
C 0.295761 -0.542659 0.165636
C -1.916000 0.664352 -0.042723
C -3.499098 0.702681 0.008119
C 0.924299 0.748556 -0.362586
C -1.870093 -1.796388 0.615473
C 1.203921 -1.758069 -0.182768
C 3.320499 -0.304344 -0.366364
C 2.409701 0.939577 -0.179187
C -1.321151 1.737493 -0.987623
C 2.649343 -1.548111 0.311603
C -1.260792 -1.166891 -1.778440
C 0.188756 1.753564 -0.910293
C -3.403509 -1.882791 0.420618
C -4.055394 -0.544335 0.744504
C 4.536171 0.057321 0.510345
C -3.952874 1.978795 0.767459
C -4.203699 0.711394 -1.390443
C 3.726850 -0.580090 -1.823913
C 4.085582 1.136017 1.508509
H 0.291843 -0.466763 1.277262
H -1.605932 0.955768 0.986146
H -1.661854 -1.557849 1.679166
H -1.426890 -2.791215 0.419410
H 1.212087 -1.929096 -1.274815
H 0.798588 -2.675372 0.284192
H 2.769457 1.768311 -0.828541
H -1.700777 2.741117 -0.714377
H -1.645943 1.568658 -2.035322
H 2.634342 -1.412321 1.411105
H 3.269706 -2.438746 0.098816
H -2.283326 -1.136575 -2.187737
H -0.628363 -0.523326 -2.415440
H -0.900143 -2.205453 -1.889919
H 0.702870 2.654434 -1.276466
H -3.849796 -2.653096 1.072900
H -3.630317 -2.160581 -0.627713
H -5.042919 1.956254 0.932425
H -3.702462 2.890495 0.196557
H -3.471902 2.044656 1.760022
H -3.874403 1.582754 -1.983097
H -5.296144 0.799151 -1.247076
H -4.015437 -0.197435 -1.985942
H 2.875364 -0.955956 -2.417311
H 4.102542 0.336587 -2.314857
H 4.536964 -1.330149 -1.852394
H 4.231408 0.821565 2.556632
H 4.670804 2.064750 1.330411


