%chk=000139848.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139848

0 1
 O   -1.066400     -0.2677000     -0.4288000    
 O  -0.8757000      0.9177000      0.3947000    
 C   -2.289900     -0.8362000      1.4500000E-02
 C   0.3552000       1.486600     -5.3700000E-02
 C   -3.404900      0.1881000     -0.1914000    
 C   -2.547000      -2.086300     -0.8242000    
 C   -2.150200      -1.199900       1.492000    
 C   0.2118000       1.852200      -1.530800    
 C   0.6121000       2.737100      0.7850000    
 C    1.443600      0.5118000      0.1361000    
 C    2.330300     -0.2839000      0.2893000    
 C    3.377900      -1.223400      0.4750000    
 C    4.003300      -1.796000     -0.5579000    
 H   -3.411100      0.5538000      -1.224700    
 H   -4.386200     -0.2482000      2.4900001E-02
 H   -3.291000       1.067800      0.4516000    
 H   -1.725100      -2.803400     -0.7161000    
 H   -2.600400      -1.835800      -1.890000    
 H   -3.479900      -2.582400     -0.5374000    
 H   -2.033200     -0.3183000       2.131800    
 H   -3.029700      -1.747100       1.848800    
 H   -1.265400      -1.825800       1.656500    
 H  -0.6745000       2.476500      -1.693700    
 H   9.8999999E-02  0.9709000      -2.173100    
 H    1.089800       2.400000      -1.892300    
 H  -0.2093000       3.454900      0.6773000    
 H    1.546900       3.233800      0.5023000    
 H   0.6692000       2.489100       1.851900    
 H    3.670300      -1.475800       1.488900    
 H    4.800900      -2.511100     -0.3861000    
 H    3.740200      -1.570400      -1.586300    


%chk=000139848-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000139848

0 1
O -1.413288 0.123581 -0.851135
O -1.058794 1.310746 0.073053
C -2.249838 -0.834986 -0.054825
C 0.341160 1.732969 -0.266652
C -3.540331 -0.131490 0.412465
C -2.539446 -1.906398 -1.129777
C -1.443667 -1.412032 1.124301
C 0.436242 2.099748 -1.764965
C 0.502716 2.975911 0.644195
C 1.313704 0.678500 0.093500
C 2.134163 -0.201869 0.385372
C 3.089739 -1.197014 0.768991
C 3.411676 -2.301551 0.032418
H -4.081153 0.293662 -0.451083
H -4.204533 -0.849218 0.928051
H -3.301238 0.688402 1.110244
H -1.600627 -2.362058 -1.489496
H -3.072131 -1.465647 -1.990047
H -3.170894 -2.700919 -0.693216
H -1.144053 -0.604439 1.812941
H -2.055962 -2.143399 1.683610
H -0.530025 -1.915003 0.763738
H -0.305656 2.883234 -1.997994
H 0.227741 1.216285 -2.388033
H 1.447270 2.474941 -2.002479
H -0.265347 3.725528 0.388264
H 1.502382 3.417357 0.491461
H 0.396869 2.698644 1.705993
H 3.588343 -1.042749 1.737610
H 4.151696 -3.022627 0.395419
H 2.943880 -2.499508 -0.937824


