%chk=000087994.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087994

0 1
 O    1.235000      0.1187000     -1.8900000E-02
 O   0.4564000       2.259000     -0.3545000    
 C    3.514000     -0.6054000      0.1038000    
 C    4.978400     -0.1788000      6.0500000E-02
 C    2.577500      0.5796000     -8.4299996E-02
 C    5.909500      -1.358200      0.2918000    
 C   -1.083500      0.4594000     -8.0700003E-02
 C   0.2685000       1.066400     -0.1703000    
 C   -3.596500     -0.6687000      8.2099997E-02
 C   -2.125500       1.219900      0.4089000    
 C   -1.256400     -0.8466000     -0.4917000    
 C   -3.395800      0.6496000      0.4913000    
 C   -2.526800      -1.416800     -0.4095000    
 C   -4.954800      -1.278200      0.1714000    
 H    3.313100      -1.355600     -0.6713000    
 H    3.289300      -1.095200       1.059700    
 H    5.168000      0.5821000      0.8267000    
 H    5.205300      0.2754000     -0.9109000    
 H    2.746800       1.321000      0.7056000    
 H    2.756100       1.047600      -1.059600    
 H    5.730700      -1.813300       1.271200    
 H    5.767500      -2.126200     -0.4753000    
 H    6.953000      -1.030100      0.2551000    
 H   -1.981100       2.246000      0.7338000    
 H  -0.4432000      -1.445800     -0.8903000    
 H   -4.220800       1.241700      0.8786000    
 H   -2.671000      -2.444500     -0.7325000    
 H   -5.101600      -2.032800     -0.6089000    
 H   -5.089900      -1.753100       1.148200    
 H   -5.736300     -0.5227000      3.7000000E-02


%chk=000087994-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087994

0 1
O 1.277378 0.071878 0.098191
O 0.493084 2.265117 0.195381
C 3.613324 -0.596080 0.031015
C 5.097618 -0.159810 0.063960
C 2.670319 0.602744 0.134180
C 6.065072 -1.357025 -0.052066
C -1.096567 0.413323 0.096349
C 0.258305 1.030694 0.135668
C -3.734480 -0.673138 0.022217
C -2.226645 1.270991 0.117839
C -1.290158 -0.990858 0.035080
C -3.526360 0.731260 0.079118
C -2.595193 -1.521206 -0.002600
C -5.137184 -1.252312 0.013383
H 3.404903 -1.144779 -0.907747
H 3.409649 -1.294847 0.865370
H 5.300128 0.390638 1.005099
H 5.291172 0.553631 -0.762762
H 2.807834 1.163573 1.077781
H 2.799175 1.311100 -0.705576
H 5.914263 -2.071372 0.779009
H 5.904608 -1.905562 -0.999132
H 7.119317 -1.026412 -0.026831
H -2.061280 2.352710 0.160783
H -0.416925 -1.648895 0.014227
H -4.392956 1.403084 0.091897
H -2.736289 -2.607565 -0.053088
H -5.171455 -2.225716 -0.506309
H -5.500864 -1.418254 1.046392
H -5.853892 -0.572509 -0.479829


