%chk=000085256.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085256

0 1
 O   -1.379200      -2.497000     -0.8782000    
 O  -0.7819000      -2.301500       1.313000    
 C  -0.4996000      0.5803000      0.4058000    
 C   8.2000000E-03 -0.6875000     -0.3064000    
 C   0.3786000       1.791900      5.6400001E-02
 C    2.354200      0.2854000     -0.4034000    
 C    1.498300     -0.9331000     -4.0800001E-02
 C    1.855900       1.531000      0.3362000    
 C   -1.957700      0.8847000      4.6700001E-02
 C    3.826200      2.4400000E-02 -8.9500003E-02
 C  -0.7439000      -1.899700      0.1595000    
 C   -2.465400       2.077100      0.8508000    
 C   -2.093700       1.144000      -1.450200    
 H  -0.4376000      0.4174000       1.491500    
 H  -9.1100000E-02 -0.5952000      -1.392900    
 H   8.7800004E-02   2.672600      0.6379000    
 H   0.3024000       2.061500      -1.001100    
 H    2.266800      0.4627000      -1.483600    
 H    1.654300      -1.187000       1.016900    
 H    1.835000      -1.806500     -0.6148000    
 H    2.442300       2.406300      3.1399999E-02
 H    2.004400       1.410900       1.417000    
 H   -2.584700      2.3700001E-02  0.3087000    
 H    4.191400     -0.8493000     -0.6396000    
 H    4.442500      0.8827000     -0.3770000    
 H    3.979800     -0.1598000      0.9793000    
 H   -2.044400       3.028800      0.5124000    
 H   -3.553100       2.161500      0.7431000    
 H   -2.252700       1.959400       1.918500    
 H   -1.582300       2.048000      -1.790400    
 H   -3.154400       1.302800      -1.684300    
 H   -1.782800      0.3021000      -2.071500    
 H   -1.877400      -3.292600     -0.5936000    


%chk=000085256-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085256

0 1
O -1.369577 -2.501869 -1.041582
O -0.931456 -2.286136 1.225443
C -0.466076 0.641877 0.332549
C 0.056400 -0.660616 -0.359764
C 0.453371 1.827464 -0.057109
C 2.457446 0.261809 -0.372507
C 1.546930 -0.930179 0.006717
C 1.933961 1.556233 0.295092
C -1.984584 0.903562 0.059985
C 3.927222 -0.022615 0.003304
C -0.772742 -1.859070 0.058644
C -2.522419 2.068303 0.927241
C -2.324698 1.135648 -1.433540
H -0.363595 0.477310 1.427614
H -0.027409 -0.553335 -1.456885
H 0.112378 2.745241 0.457451
H 0.371070 2.021437 -1.145945
H 2.398516 0.400334 -1.474678
H 1.618032 -1.119885 1.096627
H 1.896612 -1.847302 -0.507208
H 2.560400 2.416692 -0.012861
H 2.040735 1.459661 1.396358
H -2.524580 -0.011516 0.385805
H 4.304252 -0.934001 -0.497462
H 4.583024 0.819658 -0.286642
H 4.031245 -0.169980 1.095622
H -2.116053 3.043128 0.598895
H -3.624113 2.129425 0.854673
H -2.260219 1.929598 1.993127
H -1.828016 2.042920 -1.824912
H -3.414432 1.276347 -1.558481
H -2.028302 0.278337 -2.063907
H -1.887122 -3.288480 -0.713866


