%chk=000041986.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041986

0 1
 O   0.9905000      -1.427400      0.6796000    
 O    3.409300      -1.103600      9.0300001E-02
 O    2.965000      0.9844000     -0.7532000    
 O   -4.595300     -0.3436000      6.4199999E-02
 C   0.1834000      0.7404000     -0.1389000    
 C   0.1264000       1.695600       1.052700    
 C   -1.122200      8.2400002E-02 -0.5184000    
 C    1.206900     -0.3522000      0.1384000    
 C   -2.309600      0.2625000      7.4800000E-02
 C    2.630500     -6.9399998E-02 -0.2516000    
 C   -3.484900     -0.4691000     -0.4378000    
 H   0.5065000       1.302300      -1.023800    
 H    1.112300       2.133600       1.244900    
 H  -0.1790000       1.178700       1.969700    
 H  -0.5710000       2.519800      0.8691000    
 H   -1.061600     -0.5884000      -1.375200    
 H   -2.459100      0.9169000      0.9240000    
 H   -3.310000      -1.135000      -1.299200    
 H    4.352900     -0.9464000     -0.1270000    


%chk=000041986-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000041986

0 1
O 1.023931 -1.722778 0.076020
O 3.624810 -0.844822 0.316684
O 2.981469 1.141553 -0.714207
O -4.787831 0.036212 0.027282
C 0.161184 0.578017 -0.192863
C 0.206089 1.519812 1.046317
C -1.188862 -0.048464 -0.463885
C 1.245022 -0.500980 -0.072034
C -2.391266 0.378254 0.018803
C 2.693720 0.038966 -0.194197
C -3.640274 -0.310042 -0.364121
H 0.451720 1.197903 -1.071352
H 1.211765 1.952630 1.176357
H -0.076436 0.976657 1.964474
H -0.496596 2.358435 0.905193
H -1.177957 -0.926983 -1.128290
H -2.490900 1.229709 0.701916
H -3.504128 -1.190019 -1.044819
H 4.545539 -0.482563 0.195320


