%chk=000138797.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138797

0 1
 O    1.081700      0.2126000     -1.5000000E-03
 O   0.3301000       2.314000     -0.5662000    
 C    3.350800     -0.5368000      0.1494000    
 C    4.820500     -0.1470000      2.0600000E-02
 C    2.429500      0.6363000     -0.1532000    
 C    5.737600      -1.309400      0.3655000    
 C   -1.231600      0.5891000     -4.6000000E-02
 C   -2.714700      -1.283700     -0.1124000    
 C   -1.437700     -0.7526000     -0.2944000    
 C   0.1274000       1.155000     -0.2390000    
 C   -2.247000       1.422700      0.3767000    
 C   -3.757600     -0.4614000      0.3143000    
 C   -3.523700      0.8917000      0.5588000    
 C   -2.965200      -2.730700     -0.3728000    
 H    3.116900      -1.368300     -0.5273000    
 H    3.143500     -0.9074000       1.161300    
 H    5.043000      0.6942000      0.6876000    
 H    5.028900      0.1864000      -1.002600    
 H    2.632000       1.461300      0.5401000    
 H    2.589800      0.9837000      -1.180600    
 H    5.577400      -1.643500       1.395600    
 H    5.562500      -2.158700     -0.3026000    
 H    6.785200      -1.008500      0.2652000    
 H  -0.6372000      -1.401900     -0.6381000    
 H   -2.076500       2.477000      0.5737000    
 H   -4.756500     -0.8632000      0.4622000    
 H   -4.335600       1.531500      0.8924000    
 H   -2.357000      -3.089900      -1.209800    
 H   -2.723200      -3.319800      0.5173000    
 H   -4.012500      -2.912200     -0.6371000    


%chk=000138797-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000138797

0 1
O 1.106852 0.201925 0.052591
O 0.373747 2.412058 0.136680
C 3.423292 -0.527869 0.037172
C 4.920013 -0.135332 0.065731
C 2.513175 0.699605 0.082365
C 5.849195 -1.367478 0.019769
C -1.261552 0.597435 0.055823
C -2.793328 -1.331860 -0.025670
C -1.480522 -0.802434 0.001909
C 0.110615 1.183621 0.086098
C -2.364636 1.489077 0.078753
C -3.886221 -0.425805 -0.006780
C -3.674647 0.971904 0.046547
C -3.025478 -2.832918 -0.051858
H 3.206422 -1.109096 -0.879845
H 3.192355 -1.184760 0.897947
H 5.130586 0.453441 0.981478
H 5.144503 0.530007 -0.792469
H 2.655742 1.294196 1.004004
H 2.667654 1.368886 -0.784524
H 5.666326 -2.033559 0.883650
H 5.679606 -1.956751 -0.900784
H 6.913420 -1.070319 0.040430
H -0.614611 -1.471751 -0.018726
H -2.172137 2.566062 0.118049
H -4.909998 -0.818966 -0.034922
H -4.532245 1.653343 0.058828
H -2.237817 -3.354387 -0.623648
H -3.018950 -3.252886 0.972720
H -4.000562 -3.084889 -0.504221


