%chk=000003884.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003884

0 1
 O   0.4746000      -2.066200     -0.8127000    
 O   0.6289000       2.702300     -0.4340000    
 O   -1.907000       2.734500      0.2976000    
 C   0.6944000      0.3206000     -0.6432000    
 C   -1.460500     -0.8119000     -0.1492000    
 C    2.147300      0.4148000      -1.016400    
 C  -3.5000000E-02 -0.8092000     -0.5462000    
 C   -2.128300      0.3835000      0.1447000    
 C   4.5200001E-02   1.630100     -0.3537000    
 C   -1.395700       1.652600      5.4200001E-02
 C    3.027100      0.4571000      0.1936000    
 C   -2.193700      -2.007700     -5.2200001E-02
 C   -3.477100      0.3961000      0.5223000    
 C    4.030800     -0.3827000      0.5127000    
 C   -3.540300      -2.002100      0.3243000    
 C   -4.180900     -0.8013000      0.6112000    
 C    4.880700     -0.2864000       1.748000    
 C    4.389900      -1.524100     -0.4012000    
 H    2.401900     -0.3939000      -1.705200    
 H    2.328000       1.323200      -1.605400    
 H    2.830300       1.276900      0.8842000    
 H   -1.734000      -2.969900     -0.2667000    
 H   -3.991200       1.326000      0.7494000    
 H   -4.086500      -2.938500      0.3927000    
 H   -5.226700     -0.7981000      0.9035000    
 H    4.808100      -1.208900       2.333000    
 H    4.564600      0.5423000       2.390300    
 H    5.929100     -0.1208000       1.480500    
 H    4.240600      -1.297800      -1.459800    
 H    5.453300      -1.771300     -0.3019000    
 H    3.814300      -2.416800     -0.1367000    
 H    1.424200      -1.997800     -0.9978000    


%chk=000003884-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003884

0 1
O 0.767315 -1.599586 0.426711
O 0.327937 2.879735 -1.320529
O -2.450531 2.696246 -0.988084
C 0.643569 0.657579 -0.466944
C -1.419170 -0.637533 0.212277
C 2.148964 0.755105 -0.694769
C 0.037370 -0.485367 0.043911
C -2.283901 0.439624 -0.144408
C -0.176888 1.810866 -0.850291
C -1.720636 1.714896 -0.678252
C 2.992932 0.166269 0.425876
C -1.972400 -1.837877 0.719950
C -3.683563 0.301955 0.010923
C 4.040294 -0.713268 0.322249
C -3.371187 -1.965535 0.869147
C -4.230000 -0.896857 0.515605
C 4.824980 -1.129480 1.555866
C 4.531689 -1.320435 -0.980144
H 2.402455 0.290911 -1.667705
H 2.379138 1.832510 -0.810152
H 2.760250 0.562729 1.426622
H -1.300675 -2.656069 0.991724
H -4.319727 1.147899 -0.269607
H -3.791819 -2.897583 1.261547
H -5.313561 -1.000106 0.634235
H 4.823007 -2.230041 1.680242
H 4.421137 -0.674997 2.476531
H 5.886093 -0.825437 1.461254
H 3.895471 -1.079038 -1.846422
H 5.554354 -0.957863 -1.203438
H 4.600194 -2.422489 -0.898221
H 1.753314 -1.372162 0.444194


