%chk=000099966.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099966

0 1
 O    1.643600      -4.070700      0.5843000    
 O  -0.5929000      -4.004300       1.081500    
 O    2.761300       3.061900       1.676800    
 O    4.315300       2.861000     -0.1529000    
 O   -4.158000      0.4371000       2.046500    
 O   -4.814900       1.249000     -0.1253000    
 O   -3.097900       1.087100      -2.441900    
 C   0.3706000      -2.351600     -0.4239000    
 C    1.661300      -2.568700      -1.193900    
 C   0.2834000      -1.053900      0.4210000    
 C    2.243800      -1.310700      -1.814600    
 C    1.405800     -4.3099999E-02  0.2161000    
 C    2.546400      -3.264400     -0.1803000    
 C    2.336900     -0.1679000     -0.8429000    
 C   0.3779000      -3.560100      0.4871000    
 C   -1.094700     -0.4216000      0.2358000    
 C    1.516800       1.039800       1.111800    
 C    3.339800      0.8005000      -1.023800    
 C    2.522000       1.962500      0.9117000    
 C    3.407400       1.847700     -0.1300000    
 C   -1.952600     -0.3235000       1.327100    
 C   -1.468400      4.7400001E-02  -1.030000    
 C   -3.186700      0.2546000       1.110800    
 C   -2.723900      0.6290000      -1.221700    
 C   -3.562000      0.7182000     -0.1293000    
 C    3.899200       3.628100      0.9952000    
 C   -5.186300       1.068200       1.256300    
 C   -2.793100       2.448500      -2.751600    
 H  -0.4724000      -2.471800      -1.115200    
 H    1.462600      -3.288700      -2.001400    
 H   0.3707000      -1.347700       1.478500    
 H    1.612000     -0.9890000      -2.651900    
 H    3.235000      -1.541200      -2.224300    
 H    3.285400      -3.910300     -0.6641000    
 H    3.067200      -2.585600      0.5025000    
 H   0.8274000       1.153600       1.942500    
 H    4.048700      0.7266000      -1.842400    
 H   -1.674300     -0.6838000       2.311100    
 H  -0.7881000     -3.4600001E-02  -1.874200    
 H    4.736600       3.687700       1.699900    
 H    3.642800       4.641700      0.6662000    
 H   -5.410100       2.049300       1.690800    
 H   -6.090300      0.4500000       1.298600    
 H   -1.711200       2.613300      -2.725200    
 H   -3.294400       3.122300      -2.049700    
 H   -3.156100       2.659400      -3.761100    


%chk=000099966-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099966

0 1
O 2.358558 -3.714693 0.906312
O 0.992074 -3.187982 2.703925
O 3.886534 2.729279 1.616458
O 4.851194 2.375702 -0.553590
O -4.737920 -0.506968 1.010075
O -4.887093 1.256484 -0.594488
O -2.254346 2.441537 -1.905609
C 0.456694 -2.292746 0.434842
C 1.194258 -2.544283 -0.914461
C 0.305868 -0.789562 0.877985
C 1.475783 -1.245227 -1.713920
C 1.527567 0.022057 0.466656
C 2.513057 -3.268821 -0.507687
C 2.097801 -0.184975 -0.820781
C 1.249986 -3.081563 1.493190
C -1.037424 -0.197582 0.399195
C 2.066610 0.996065 1.353564
C 3.226168 0.571345 -1.247880
C 3.161797 1.736413 0.908648
C 3.729215 1.529348 -0.366526
C -2.234981 -0.727741 0.970723
C -1.111384 0.845699 -0.545380
C -3.438563 -0.179432 0.535603
C -2.351477 1.404649 -0.974999
C -3.522015 0.859301 -0.418070
C 4.859256 3.274920 0.633028
C -5.666498 0.197727 0.096622
C -3.494355 3.069261 -2.398432
H -0.555580 -2.734084 0.416038
H 0.585352 -3.221886 -1.538718
H 0.255370 -0.812097 1.985355
H 0.519089 -0.880430 -2.135749
H 2.135900 -1.468093 -2.573426
H 2.719007 -4.172109 -1.102973
H 3.383702 -2.590683 -0.536004
H 1.637330 1.155820 2.346399
H 3.678169 0.412233 -2.231019
H -2.212276 -1.510727 1.734343
H -0.202678 1.280488 -0.970979
H 5.864951 3.267145 1.080945
H 4.530026 4.283730 0.320972
H -6.464197 0.671188 0.687586
H -6.049367 -0.520150 -0.655784
H -4.062216 3.529446 -1.571480
H -4.133754 2.332413 -2.915517
H -3.153594 3.840883 -3.104491


