%chk=000068879.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068879

0 1
 O    5.317700      -1.505600     -0.1705000    
 O  -0.6452000      0.9302000      -2.461900    
 O    3.163100      -2.042300     -0.7144000    
 O   -2.358500       2.377500      7.9099998E-02
 C    3.690200      0.2152000     -0.1483000    
 C    3.950700      0.6255000       1.312600    
 C    2.626000      0.4464000       2.074600    
 C    2.223100      0.4903000     -0.2778000    
 C    1.624600      0.6324000      0.9797000    
 C   0.2647000      0.8634000       1.102200    
 C    1.472500      0.5865000      -1.438800    
 C    4.008200      -1.227000     -0.3772000    
 C  -0.4973000      0.9681000     -6.3199997E-02
 C   0.1024000      0.8311000      -1.324900    
 C   -1.927900       1.216200      5.3399999E-02
 C   -2.925500      0.1092000      0.1450000    
 C   -2.472100      -1.189700      0.1191000    
 C   -4.258900      0.4311000      0.2525000    
 C   -3.404000      -2.224100      0.2051000    
 C   -5.190700     -0.6033000      0.3386000    
 C   -4.763200      -1.931000      0.3149000    
 H    4.268500      0.8303000     -0.8459000    
 H    4.223700       1.690200       1.334400    
 H    4.766900      7.9800002E-02   1.797100    
 H    2.520400       1.190200       2.869400    
 H    2.544300     -0.5626000       2.491300    
 H  -0.1915000      0.9584000       2.082800    
 H    1.938400      0.4730000      -2.412400    
 H    5.519200      -2.453500     -0.3225000    
 H   -1.570100       1.129900      -2.246200    
 H   -1.424500      -1.457100      3.4600001E-02
 H   -4.615300       1.456200      0.2729000    
 H   -3.071700      -3.258000      0.1867000    
 H   -6.249200     -0.3755000      0.4241000    
 H   -5.488700      -2.736400      0.3819000    


%chk=000068879-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068879

0 1
O 4.974918 -0.377115 -1.618118
O 0.031813 1.642730 -2.798186
O 4.563295 -1.885695 0.100535
O -2.301603 1.240139 -1.985620
C 3.805490 0.475699 0.309738
C 3.659305 0.292036 1.851277
C 2.251713 -0.344726 2.070886
C 2.351330 0.581097 -0.169159
C 1.467019 0.109261 0.848804
C 0.089615 0.109520 0.619547
C 1.880949 1.067105 -1.391740
C 4.470068 -0.727236 -0.358006
C -0.440553 0.576563 -0.627184
C 0.479067 1.099782 -1.619655
C -1.878718 0.591202 -0.938992
C -2.902901 -0.126636 -0.118472
C -2.672311 -1.409884 0.448417
C -4.188861 0.465595 0.008319
C -3.703796 -2.073652 1.147115
C -5.210485 -0.190699 0.722881
C -4.970084 -1.462277 1.297190
H 4.387457 1.369922 0.028230
H 3.695394 1.289271 2.325704
H 4.468352 -0.325069 2.274767
H 1.791906 -0.027689 3.023670
H 2.331317 -1.448579 2.090743
H -0.599911 -0.214189 1.404905
H 2.548603 1.443738 -2.171252
H 5.358028 -1.183264 -2.059769
H -1.008476 1.645553 -2.743983
H -1.707967 -1.907419 0.304152
H -4.367057 1.436072 -0.465776
H -3.522547 -3.069977 1.564680
H -6.193555 0.281014 0.826531
H -5.766512 -1.977197 1.845822


