%chk=000031791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031791

0 1
 O   0.2932000     -0.8514000      6.9600001E-02
 O    2.751400      0.8090000     -0.2216000    
 O    2.544200      -1.343500      0.6931000    
 O   -2.225000      0.3066000      0.5811000    
 O   -3.545500     -0.7131000      -1.073400    
 O   0.7091000       2.694300     -0.3493000    
 C  -8.4399998E-02  0.3905000     -0.5535000    
 C    1.766200      0.8501000      0.8145000    
 C   0.4831000       1.483900      0.3398000    
 C    1.371400     -0.5946000      0.9909000    
 C   -1.594900      0.4485000     -0.6951000    
 C    3.357900     -0.4854000     -0.1160000    
 C   -2.180100     -0.6919000      -1.492200    
 C   -3.515000     -0.2555000      0.2886000    
 C    3.481400      -1.081900      -1.511600    
 C    4.723500     -0.3452000      0.5466000    
 C   -3.752800      -1.435900       1.222000    
 C   -4.583700      0.8154000      0.4666000    
 H   0.3699000      0.4209000      -1.552000    
 H    2.210900       1.317100       1.697900    
 H  -0.1665000       1.682000       1.199600    
 H    1.015200     -0.8290000       1.998600    
 H   -1.908500       1.412300      -1.115100    
 H   -2.115800     -0.5380000      -2.572700    
 H   -1.741300      -1.664100      -1.243900    
 H    1.329200       2.515600      -1.076700    
 H    2.493800      -1.179200      -1.976600    
 H    4.084300     -0.4433000      -2.165700    
 H    3.922300      -2.083700      -1.478800    
 H    5.214800      -1.317800      0.6548000    
 H    5.374500      0.3264000     -2.2700001E-02
 H    4.622000      7.8299999E-02   1.552400    
 H   -4.713500      -1.919000       1.015700    
 H   -2.973200      -2.194700       1.087900    
 H   -3.722900      -1.125300       2.271600    
 H   -4.403200       1.655600     -0.2137000    
 H   -5.580700      0.4242000      0.2384000    
 H   -4.578000       1.217300       1.485100    


%chk=000031791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000031791

0 1
O 0.108831 -0.804034 0.059135
O 2.815608 0.876954 0.171016
O 2.363172 -1.346382 0.850533
O -2.378608 0.837125 0.206108
O -3.623286 -0.664935 -1.110580
O 0.980951 2.698884 -0.662496
C -0.112306 0.437671 -0.725123
C 1.569411 0.900897 0.975726
C 0.473422 1.595288 0.135236
C 1.148383 -0.584136 1.078242
C -1.603370 0.602159 -1.034910
C 3.311167 -0.536125 0.042781
C -2.264954 -0.645027 -1.682497
C -3.486166 -0.169432 0.275846
C 3.268863 -0.951927 -1.430746
C 4.691336 -0.645777 0.687495
C -3.091687 -1.301051 1.237321
C -4.777884 0.552336 0.646844
H 0.445782 0.376490 -1.684237
H 1.767328 1.384512 1.945377
H -0.312523 2.011408 0.785737
H 0.747128 -0.933472 2.040618
H -1.715882 1.502050 -1.671630
H -2.380727 -0.559608 -2.773965
H -1.711426 -1.567183 -1.424247
H 1.893209 2.433239 -0.963007
H 2.233317 -0.940983 -1.806272
H 3.886740 -0.267262 -2.037242
H 3.663532 -1.976444 -1.540203
H 5.029591 -1.696163 0.677999
H 5.420189 -0.032208 0.131262
H 4.650278 -0.294650 1.731100
H -3.874354 -2.079576 1.242109
H -2.129943 -1.747374 0.934929
H -2.982103 -0.901818 2.261066
H -4.992354 1.335545 -0.097368
H -5.618599 -0.162128 0.670681
H -4.678767 1.018636 1.641560


