%chk=000023580.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023580

0 1
 O   -1.937800     -0.2368000      0.4857000    
 O    4.225900     -0.8480000     -0.4010000    
 O    4.180300       1.424400     -0.4154000    
 C  -0.3645000      -2.595500      0.2769000    
 C  -0.8880000       2.399400      0.3119000    
 C   0.2170000      -1.223400      0.1810000    
 C  -3.4899998E-02   1.179300      0.1976000    
 C  -0.5954000     -9.4700001E-02  0.2895000    
 C    1.589700      -1.078300     -1.9500000E-02
 C    1.337800       1.324500     -2.9000000E-03
 C    2.150100      0.1957000     -0.1114000    
 C   0.1898000      -3.385400       1.476800    
 C  -0.1725000      -3.406500      -1.017800    
 C  -0.8700000       3.250700     -0.9709000    
 C  -0.5080000       3.270000       1.523700    
 C    3.581400      0.3482000     -0.3195000    
 C   -2.756400     -0.3146000     -0.6786000    
 C   -4.172600     -0.5241000     -0.2562000    
 C   -5.171800      0.3154000     -0.5496000    
 H   -1.446400      -2.542700      0.4425000    
 H   -1.935300       2.121200      0.4750000    
 H    2.206100      -1.969000     -0.1016000    
 H    1.778300       2.315700     -7.4900001E-02
 H    1.260700      -3.591000       1.375500    
 H  -0.3245000      -4.347900       1.573100    
 H   4.1099999E-02  -2.830400       2.409800    
 H  -0.5767000      -2.866100      -1.880800    
 H  -0.6946000      -4.367100     -0.9491000    
 H   0.8833000      -3.617300      -1.218600    
 H   0.1196000       3.676800      -1.167600    
 H   -1.578600       4.082100     -0.8891000    
 H   -1.155800       2.650700      -1.841800    
 H  -0.5383000       2.683500       2.448800    
 H   -1.209600       4.104400       1.632100    
 H   0.4976000       3.693000       1.427200    
 H   -2.651000      0.5997000      -1.273700    
 H   -2.446200      -1.160100      -1.303200    
 H   -4.395000      -1.418600      0.3197000    
 H    5.190200     -0.7343000     -0.5407000    
 H   -6.181700      0.1053000     -0.2150000    
 H   -5.002800       1.220300      -1.122800    


%chk=000023580-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023580

0 1
O -1.975975 -0.229329 0.522707
O 4.337566 -0.843027 -0.475146
O 4.225603 1.474563 -0.474269
C -0.396519 -2.667321 0.309024
C -0.895152 2.466277 0.358325
C 0.216530 -1.271713 0.169508
C -0.024565 1.217678 0.194767
C -0.580635 -0.093740 0.271392
C 1.603500 -1.112430 -0.042189
C 1.365704 1.328828 -0.017117
C 2.179688 0.176763 -0.143494
C 0.196537 -3.415740 1.533048
C -0.218839 -3.502852 -0.986941
C -0.887633 3.339658 -0.925106
C -0.449018 3.298110 1.590786
C 3.632639 0.371453 -0.372860
C -2.811078 -0.280531 -0.714880
C -4.235654 -0.515009 -0.292914
C -5.284561 0.238390 -0.704090
H -1.478395 -2.537322 0.495682
H -1.930347 2.127618 0.546850
H 2.254370 -1.987545 -0.128335
H 1.845924 2.311256 -0.085496
H 1.283700 -3.580568 1.414963
H -0.284720 -4.404650 1.649159
H 0.038868 -2.842424 2.463896
H -0.660778 -2.992583 -1.862757
H -0.706518 -4.489598 -0.879780
H 0.850812 -3.677367 -1.206558
H 0.127696 3.718533 -1.145139
H -1.553627 4.213356 -0.798632
H -1.230310 2.769128 -1.808424
H -0.488645 2.693360 2.514168
H -1.111951 4.173426 1.721494
H 0.584992 3.671376 1.471271
H -2.703680 0.666829 -1.279895
H -2.440311 -1.112737 -1.351390
H -4.392594 -1.369939 0.378982
H 5.298254 -0.634555 -0.626146
H -6.310116 0.007215 -0.396651
H -5.150260 1.105663 -1.362716


