%chk=000064602.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064602

0 1
 O   -4.051900      -1.995100     -9.5200002E-02
 O   -3.200100       2.012800     -0.3611000    
 O   -4.631600      0.5490000      0.6705000    
 C    1.311100     -0.2396000     -3.1000001E-03
 C    3.763700     -0.9774000     -0.1076000    
 C    3.078700       1.199700      -1.157900    
 C    3.114300      0.9625000       1.350900    
 C    2.297500      -1.441800     -0.1305000    
 C    1.614000      0.7283000      -1.185400    
 C    1.649500      0.4905000       1.330500    
 C    4.007700     -1.6300000E-02  -1.279500    
 C    4.042900     -0.2523000       1.216300    
 C    3.354700       1.919800      0.1721000    
 C  -0.1077000     -0.6976000     -2.6600000E-02
 C   -1.143200      0.2315000      7.5700000E-02
 C  -0.3999000      -2.056000     -0.1510000    
 C   -2.470200     -0.1975000      5.3500000E-02
 C   -1.727000      -2.485000     -0.1732000    
 C   -2.762100      -1.555700     -7.1000002E-02
 C   -3.536200      0.7891000      0.1611000    
 C   -4.204400       3.031100     -0.2883000    
 H    4.427100      -1.844900     -0.1990000    
 H    3.259500       1.885800      -1.992900    
 H    3.320200       1.480600       2.294300    
 H    2.136700      -1.985400      -1.071800    
 H    2.161700      -2.152300      0.6965000    
 H   0.9624000       1.610600      -1.148400    
 H    1.403900      0.2323000      -2.142800    
 H    1.465000     -0.1766000       2.183600    
 H    1.000000       1.362700       1.478000    
 H    5.054800      0.3104000      -1.285000    
 H    3.830200     -0.5311000      -2.231700    
 H    3.890700     -0.9369000       2.059800    
 H    5.090600      7.0299998E-02   1.253700    
 H    4.389100       2.284600      0.1919000    
 H    2.705600       2.799300      0.2644000    
 H  -0.9138000       1.288100      0.1846000    
 H   0.3451000      -2.837800     -0.2353000    
 H   -1.948800      -3.544500     -0.2704000    
 H   -4.669500      -1.247000     -8.0200002E-02
 H   -5.092800       2.726400     -0.8493000    
 H   -3.798900       3.940800     -0.7390000    
 H   -4.457200       3.238400      0.7558000    


%chk=000064602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064602

0 1
O -4.161740 -2.021903 -0.153866
O -3.174128 2.119159 0.028577
O -4.830093 0.491232 -0.056441
C 1.376092 -0.297443 -0.033374
C 3.851862 -0.964827 -0.031556
C 3.131595 1.143247 -1.233596
C 3.106560 1.053977 1.300184
C 2.387803 -1.482109 -0.064805
C 1.671749 0.619032 -1.269516
C 1.646680 0.529301 1.269937
C 4.112236 -0.058180 -1.264891
C 4.086996 -0.147515 1.267377
C 3.356812 1.962755 0.065983
C -0.091814 -0.762490 -0.065132
C -1.132628 0.189006 -0.037014
C -0.470501 -2.137267 -0.123595
C -2.502060 -0.188077 -0.064118
C -1.816193 -2.543138 -0.152613
C -2.852511 -1.581053 -0.123626
C -3.588929 0.798833 -0.032187
C -4.253984 3.135601 0.065113
H 4.539713 -1.833300 -0.055543
H 3.306348 1.789722 -2.116587
H 3.262716 1.636872 2.229694
H 2.232280 -2.086169 -0.982099
H 2.213497 -2.149439 0.803960
H 0.967901 1.474271 -1.282155
H 1.494399 0.042375 -2.199601
H 1.451334 -0.111731 2.153194
H 0.941924 1.381697 1.329478
H 5.160130 0.303213 -1.255882
H 3.972946 -0.637033 -2.200211
H 3.929202 -0.790435 2.156784
H 5.134720 0.212515 1.304523
H 4.391802 2.359380 0.090368
H 2.672436 2.835079 0.090054
H -0.910809 1.259763 0.008033
H 0.302141 -2.911534 -0.146961
H -2.093362 -3.600328 -0.197584
H -4.770433 -1.205644 -0.126028
H -4.876001 3.063635 -0.842397
H -3.726180 4.098168 0.111457
H -4.889108 2.984580 0.953663


