%chk=000043201.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043201

0 1
 I   -6.879800      -2.469800     -0.7963000    
 O    1.387000      0.7876000      9.3000000E-03
 O    5.035800      -1.120300     -0.4637000    
 O  -0.8079000      0.7634000      0.2567000    
 O    3.606900     -0.4462000       1.217200    
 O   0.3786000       2.552100       1.096900    
 C    2.490800       1.580200     -0.4242000    
 C    3.579900      0.6492000     -0.9587000    
 C    2.006500       2.536800      -1.505800    
 C    4.046100     -0.3501000      7.9599999E-02
 C   -3.172600      0.4482000      0.3633000    
 C   -2.028100       1.349600      0.7221000    
 C   0.3235000       1.477500      0.5144000    
 C    5.585600      -2.118400      0.4024000    
 C   -3.822700      0.6121000     -0.8547000    
 C   -3.572700     -0.5428000       1.252700    
 C   -4.886900     -0.2261000      -1.187500    
 C   -4.636900      -1.380900      0.9197000    
 C   -5.294000      -1.222500     -0.3004000    
 C    6.661000      -2.879800     -0.3429000    
 H    2.887400       2.141400      0.4314000    
 H    3.188600      7.1300000E-02  -1.804700    
 H    4.444200       1.236200      -1.288200    
 H    1.476500       1.997500      -2.299200    
 H    2.848500       3.073300      -1.955800    
 H    1.315000       3.290600      -1.117800    
 H   -1.981100       1.488400       1.809500    
 H   -2.163700       2.336300      0.2617000    
 H    4.793000      -2.807500      0.7147000    
 H    6.018100      -1.636600       1.286400    
 H   -3.512400       1.383600      -1.553900    
 H   -3.066600     -0.6760000       2.204800    
 H   -5.384900     -8.5699998E-02  -2.143700    
 H   -4.937600      -2.151300       1.625400    
 H    7.103800      -3.652800      0.2914000    
 H    6.247200      -3.352400      -1.239800    
 H    7.452200      -2.200700     -0.6775000    


%chk=000043201-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043201

0 1
I -6.439196 -3.311486 -0.256859
O 1.467069 1.244259 -0.784131
O 4.566989 -1.144567 -0.196699
O -0.682318 0.907349 -0.309474
O 3.672570 0.275404 1.420771
O 0.331834 2.871674 0.482686
C 2.741976 2.050362 -0.693340
C 3.848985 1.020154 -0.932792
C 2.709515 3.174615 -1.732907
C 3.991499 0.048550 0.231365
C -2.972683 0.244366 0.162093
C -1.946123 1.340187 0.349158
C 0.377008 1.786179 -0.140234
C 4.803623 -2.179491 0.861262
C -4.349074 0.576292 0.165361
C -2.594221 -1.113152 0.029935
C -5.339018 -0.426017 0.053737
C -3.572209 -2.126130 -0.091501
C -4.939086 -1.773533 -0.073602
C 5.436566 -3.380426 0.167203
H 2.797739 2.455421 0.332951
H 3.668361 0.457751 -1.864044
H 4.813246 1.551296 -1.054152
H 2.602111 2.767530 -2.753732
H 3.646452 3.759449 -1.685984
H 1.871517 3.861464 -1.529357
H -1.727798 1.525655 1.418566
H -2.278015 2.294988 -0.097417
H 3.831771 -2.420080 1.328233
H 5.458252 -1.739493 1.635234
H -4.663976 1.623277 0.253590
H -1.532548 -1.374975 0.001715
H -6.398122 -0.154172 0.058088
H -3.266826 -3.170727 -0.199683
H 5.628391 -4.180110 0.905641
H 4.768185 -3.781463 -0.613588
H 6.395854 -3.104997 -0.303295


