%chk=000070329.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070329

0 1
 O    1.072600      0.4593000      0.5587000    
 O    4.163400      -1.037900     -0.4781000    
 O    3.604400       1.149100     -0.1740000    
 C   -2.972500     -0.1300000     -0.1619000    
 C  -0.2536000      0.2654000      0.3219000    
 C   -2.437300       1.157400     -0.2008000    
 C   -2.148300      -1.219800      0.1190000    
 C   -1.077800       1.355100      4.0899999E-02
 C  -0.7889000      -1.022000      0.3609000    
 C   -4.425500     -0.3418000     -0.4213000    
 C    1.958400     -0.5991000      0.1971000    
 C    3.305100     -3.5500001E-02 -0.1623000    
 H   -3.068600       2.014300     -0.4204000    
 H   -2.554800      -2.227100      0.1559000    
 H  -0.6662000       2.360200      8.7000001E-03
 H  -0.1870000      -1.893300      0.6017000    
 H   -4.805300      -1.203200      0.1388000    
 H   -5.013900      0.5276000     -0.1088000    
 H   -4.595400     -0.5146000      -1.488600    
 H    2.077100      -1.272400       1.052400    
 H    1.602200      -1.137700     -0.6899000    
 H    5.051800     -0.6974000     -0.7170000    


%chk=000070329-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070329

0 1
O 1.123604 0.549768 -0.128826
O 4.350149 -1.090623 0.122953
O 3.834138 1.167093 -0.145228
C -3.078931 -0.138638 -0.113226
C -0.254084 0.239998 -0.114646
C -2.510037 1.158982 -0.246204
C -2.194631 -1.234133 0.017687
C -1.117697 1.354069 -0.247991
C -0.788810 -1.062391 0.019079
C -4.586107 -0.329460 -0.111971
C 2.043117 -0.561048 0.015826
C 3.460997 -0.009605 -0.018486
H -3.170526 2.028591 -0.349946
H -2.603697 -2.246405 0.121131
H -0.676787 2.350275 -0.350209
H -0.143346 -1.940205 0.122850
H -4.858874 -1.395121 -0.021321
H -5.060917 0.210525 0.729137
H -5.042788 0.055507 -1.043302
H 1.896245 -1.096730 0.976715
H 1.932549 -1.299913 -0.805041
H 5.286333 -0.753940 0.103920


