%chk=000046533.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046533

0 1
 O   0.8375000      0.2587000     -0.7018000    
 O    4.045600      0.6637000      0.8502000    
 O   -1.481900      -2.966100      0.2165000    
 O    3.251000     -0.9888000     -0.5010000    
 C  -0.4657000      0.4556000     -0.3554000    
 C   -1.292400     -0.6211000     -3.4400001E-02
 C  -0.9699000       1.755800     -0.3239000    
 C   -2.623500     -0.3975000      0.3180000    
 C   -2.301200       1.979400      2.8200001E-02
 C   -3.128100      0.9027000      0.3490000    
 C    1.826100      0.8800000      0.1167000    
 C  -0.7863000      -1.986300     -6.0400002E-02
 C    3.088700      6.3699998E-02  9.8200001E-02
 H  -0.3408000       2.604100     -0.5794000    
 H   -3.287800      -1.219300      0.5722000    
 H   -2.694500       2.991500      5.0700001E-02
 H    2.044300       1.873900     -0.2872000    
 H    1.483400      0.9515000       1.156000    
 H   -4.164600       1.077000      0.6226000    
 H   0.2695000      -2.129300     -0.3434000    
 H    4.882100      0.1512000      0.8551000    


%chk=000046533-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000046533

0 1
O 0.870220 -0.135139 0.091058
O 4.260813 1.132752 0.229225
O -1.888275 -3.119092 -0.133424
O 3.473391 -1.058498 0.076990
C -0.466349 0.293310 0.090812
C -1.445808 -0.743501 0.012228
C -0.859726 1.651686 0.162234
C -2.818777 -0.386435 0.006847
C -2.235039 1.974712 0.154526
C -3.219994 0.961314 0.077025
C 1.908576 0.877028 0.169068
C -1.050306 -2.175571 -0.064034
C 3.252398 0.159985 0.149542
H -0.121110 2.456150 0.223458
H -3.547397 -1.202656 -0.054083
H -2.535387 3.026993 0.209941
H 1.865443 1.576020 -0.690420
H 1.834377 1.469916 1.102913
H -4.281993 1.225529 0.071972
H 0.042692 -2.377927 -0.057013
H 5.153752 0.693826 0.217634


