%chk=000016522.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016522

0 1
 O    2.238300      -1.569700      0.3530000    
 O    2.958800       1.035300     -0.2933000    
 O   -3.267800      0.7049000     -0.1257000    
 O   -2.866400      -1.498900      0.4044000    
 C    1.284600     -0.6222000      0.1339000    
 C   -1.048600     -6.3000000E-03  1.4200000E-02
 C    1.646300      0.6855000     -0.1901000    
 C  -6.2899999E-02 -0.9681000      0.2361000    
 C  -0.6867000       1.301300     -0.3098000    
 C   0.6607000       1.647300     -0.4119000    
 C   -2.453500     -0.3663000      0.1223000    
 C    2.676300      -2.322200     -0.7768000    
 C    3.599900       1.503100      0.8918000    
 C   -4.679000      0.4764000     -4.8099998E-02
 H  -0.3306000      -1.990900      0.4906000    
 H   -1.419000       2.082900     -0.4910000    
 H   0.9359000       2.667500     -0.6655000    
 H    3.116500      -1.663100      -1.531700    
 H    1.842800      -2.885000      -1.208900    
 H    3.439900      -3.029600     -0.4421000    
 H    3.584100      0.7321000       1.668600    
 H    3.114700       2.414100       1.256100    
 H    4.640900       1.734100      0.6496000    
 H   -4.981000     -0.2708000     -0.7879000    
 H   -5.189000       1.417700     -0.2692000    
 H   -4.953700      0.1548000      0.9608000    


%chk=000016522-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016522

0 1
O 2.164214 -1.528446 0.510066
O 2.929336 1.156038 -0.393201
O -3.460918 0.733261 -0.175535
O -2.985088 -1.420426 0.577011
C 1.202815 -0.541180 0.186737
C -1.157028 0.097887 0.009003
C 1.585198 0.768642 -0.238942
C -0.159276 -0.858861 0.325378
C -0.777234 1.381276 -0.464595
C 0.586458 1.708973 -0.582801
C -2.581159 -0.300398 0.174550
C 2.958346 -2.003903 -0.648106
C 3.776305 1.050056 0.821398
C -4.898868 0.412376 -0.035227
H -0.449085 -1.857051 0.668022
H -1.551258 2.109489 -0.719132
H 0.908403 2.697278 -0.925200
H 3.498745 -1.168125 -1.129440
H 2.296148 -2.495930 -1.384985
H 3.668921 -2.735595 -0.235037
H 3.757662 0.025878 1.232357
H 3.422617 1.767979 1.584623
H 4.789537 1.322110 0.490163
H -5.166530 -0.439933 -0.682479
H -5.422855 1.326972 -0.346775
H -5.133905 0.155533 1.011547


