%chk=000014235.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014235

0 1
 O    2.042700      0.1982000     -0.8023000    
 O    2.124100       1.350800       1.198200    
 C    1.911800      -1.036000     -9.3500003E-02
 C   0.6123000     -0.9845000      0.7354000    
 C  -0.6571000     -0.7198000     -8.6499996E-02
 C    1.818000      -2.163800      -1.126500    
 C    3.154500      -1.228400      0.7785000    
 C   -1.896100     -0.6633000      0.8179000    
 C   -3.163600     -0.3620000      4.6399999E-02
 C    2.139400       1.315100     -2.4800001E-02
 C   -3.537200       1.013600     -0.2558000    
 C   -3.938700      -1.371100     -0.3884000    
 C    2.271200       2.525900     -0.8981000    
 C   -2.881200       2.125300      9.9500000E-02
 H   0.4935000      -1.955000       1.238300    
 H   0.6534000     -0.2615000       1.553800    
 H  -0.8036000      -1.511700     -0.8292000    
 H  -0.5563000      0.2235000     -0.6348000    
 H    1.587100      -3.127100     -0.6603000    
 H    1.072000      -1.951100      -1.899100    
 H    2.769500      -2.266500      -1.662400    
 H    4.067900     -0.9868000      0.2229000    
 H    3.228600      -2.269400       1.114900    
 H    3.157800     -0.6222000       1.687900    
 H   -1.999500      -1.632000       1.326700    
 H   -1.756000      6.3900001E-02   1.626600    
 H   -4.453400       1.148200     -0.8289000    
 H   -3.677700      -2.406000     -0.1897000    
 H   -4.849100      -1.196600     -0.9534000    
 H    1.385200       2.623900      -1.530500    
 H    3.174100       2.446100      -1.508600    
 H    2.352100       3.418200     -0.2709000    
 H   -3.269500       3.097100     -0.1884000    
 H   -1.958800       2.112500      0.6679000    


%chk=000014235-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014235

0 1
O 2.052602 0.228056 -0.756377
O 1.722098 1.588721 1.129630
C 1.942559 -1.099063 -0.001329
C 0.588659 -1.188301 0.752993
C -0.665867 -0.862431 -0.086314
C 2.052716 -2.122946 -1.144029
C 3.134766 -1.207010 0.969856
C -1.948278 -0.839073 0.792623
C -3.175221 -0.340834 0.038771
C 1.921198 1.449162 -0.101710
C -3.330665 1.107585 -0.217115
C -4.130398 -1.207618 -0.418435
C 2.025756 2.584690 -1.102418
C -2.505882 2.103994 0.217518
H 0.511121 -2.221120 1.151356
H 0.628206 -0.507038 1.621528
H -0.805326 -1.603005 -0.896616
H -0.541205 0.119266 -0.577705
H 1.975054 -3.147928 -0.738779
H 1.253004 -1.976704 -1.888865
H 3.023428 -2.021102 -1.658942
H 4.088910 -1.093593 0.425505
H 3.129947 -2.201820 1.452092
H 3.073766 -0.436068 1.754708
H -2.139830 -1.858497 1.179096
H -1.761414 -0.194284 1.674628
H -4.216598 1.383181 -0.809943
H -4.063730 -2.286696 -0.238783
H -5.004222 -0.855276 -0.980583
H 1.077512 2.667087 -1.664990
H 2.828870 2.391967 -1.831746
H 2.206178 3.530563 -0.570581
H -2.720476 3.153709 -0.011063
H -1.609836 1.909928 0.818818


