%chk=000080671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080671

0 1
 O   0.4091000      0.2365000     -0.6485000    
 O   -1.002000       2.536300      1.9500000E-02
 O   -4.824900      -2.549000      6.8000004E-02
 C    1.267600      0.7283000      0.3789000    
 C  -0.9220000      0.1745000     -0.3660000    
 C    2.624800      0.1082000      0.2217000    
 C   -1.630100       1.328600     -3.1099999E-02
 C   -1.576700      -1.056200     -0.4136000    
 C   -2.939600      -1.132800     -0.1264000    
 C   -2.993000       1.252000      0.2564000    
 C    2.913500      -1.089500      0.8664000    
 C    3.581900      0.7369000     -0.5669000    
 C   -3.647600      2.1299999E-02  0.2086000    
 C    4.175500      -1.665900      0.7206000    
 C    4.843700      0.1605000     -0.7127000    
 C    5.140500      -1.040800     -6.8999998E-02
 C   -3.622500      -2.415800     -0.1759000    
 C   -1.798000       3.666700      0.3700000    
 H   0.8685000      0.5020000       1.377100    
 H    1.355000       1.817900      0.2977000    
 H   -1.016200      -1.950700     -0.6751000    
 H   -3.606000       2.105700      0.5240000    
 H    2.168200      -1.585900       1.481700    
 H    3.361200       1.671700      -1.074700    
 H   -4.709900     -1.5699999E-02  0.4362000    
 H    4.406400      -2.601600       1.221300    
 H    5.595100      0.6468000      -1.328100    
 H    6.122900      -1.489600     -0.1829000    
 H   -3.010000      -3.292600     -0.4468000    
 H   -2.196600       3.580000       1.386600    
 H   -2.582400       3.853600     -0.3713000    
 H   -1.137900       4.540400      0.3612000    


%chk=000080671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000080671

0 1
O 0.351689 -0.065826 -0.459001
O -0.977720 2.431232 -0.084786
O -5.089044 -2.641228 0.299710
C 1.318173 0.771137 0.309423
C -1.015567 0.025071 -0.161446
C 2.693968 0.156610 0.156987
C -1.729608 1.255735 0.017268
C -1.733825 -1.184572 -0.133586
C -3.135850 -1.206709 0.085053
C -3.129338 1.232291 0.258533
C 2.885098 -1.243976 0.263476
C 3.819264 0.991220 -0.051387
C -3.828337 0.014241 0.291538
C 4.179949 -1.798070 0.168518
C 5.118346 0.439150 -0.135913
C 5.302108 -0.957835 -0.026049
C -3.849943 -2.502275 0.102428
C -1.683999 3.713517 0.031806
H 0.998016 0.777097 1.371953
H 1.292218 1.806509 -0.067898
H -1.175859 -2.114829 -0.292353
H -3.673762 2.169801 0.404023
H 2.013217 -1.892276 0.399799
H 3.680853 2.075047 -0.151535
H -4.908329 -0.017665 0.468655
H 4.316130 -2.882695 0.246099
H 5.980949 1.095588 -0.296429
H 6.307246 -1.388353 -0.097525
H -3.199034 -3.396128 -0.078278
H -2.145281 3.827793 1.031031
H -2.456231 3.813704 -0.753844
H -0.906995 4.478494 -0.109370


