%chk=000162305.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162305

0 1
 O   -1.695400      0.1527000      0.5422000    
 O  -0.3966000      0.6765000      -1.324000    
 O   -4.279500      -2.094100      -1.725200    
 O   -5.073900      -1.212500      0.9105000    
 O   -2.541800     -8.7600000E-02  -3.003900    
 O   -2.133100      0.8234000       3.171900    
 O    2.820300     -0.5113000      -1.158100    
 O   0.2876000       5.208200     -4.1099999E-02
 O    1.769800      -3.243100       1.774400    
 O    4.007400      -2.114500      -2.247000    
 C   -3.796600     -0.8991000      -1.109300    
 C   -3.745500      -1.132900      0.4006000    
 C   -2.412400     -0.5637000      -1.664600    
 C   -3.001800      6.3999998E-03   1.101700    
 C   -1.728300      0.5223000     -0.8343000    
 C   -2.835500     -0.2619000       2.594200    
 C   0.3700000       1.608300     -0.6901000    
 C    1.559400       1.257200     -5.0400000E-02
 C  -5.6600001E-02   2.936800     -0.6868000    
 C    2.321000       2.233300      0.5920000    
 C    2.004400     -0.1488000     -5.4299999E-02
 C   0.7052000       3.912900     -4.4399999E-02
 C    1.894000       3.561100      0.5949000    
 C    3.599900       1.895600       1.289500    
 C    1.669700      -1.046500      0.8838000    
 C    2.157600      -2.391100      0.7671000    
 C    3.300600      -1.785100      -1.300200    
 C    2.930700      -2.763600     -0.2587000    
 C    2.299600      -4.538900       1.569800    
 H   -4.515100     -0.1092000      -1.360700    
 H   -3.257800      -2.094200      0.6042000    
 H   -1.791200      -1.466200      -1.707300    
 H   -3.538700      0.9579000      0.9863000    
 H   -2.274800       1.466900     -0.9529000    
 H   -3.801100     -0.3556000       3.099200    
 H   -2.252300      -1.170900       2.775100    
 H   -5.152300      -2.286900      -1.342000    
 H   -5.512100     -0.3611000      0.7412000    
 H   -3.092400      0.7137000      -2.987600    
 H   -1.279400      0.8996000       2.712000    
 H  -0.9687000       3.232700      -1.198300    
 H    2.483400       4.325800       1.095200    
 H    4.302300       1.413800      0.6012000    
 H    3.410600       1.233600       2.140800    
 H    4.099300       2.789700       1.679100    
 H    1.040700     -0.7844000       1.728000    
 H   0.9334000       5.746900      0.4476000    
 H    3.339200      -3.752500     -0.4238000    
 H    3.394900      -4.557200       1.619300    
 H    1.952500      -5.158200       2.404900    
 H    1.907300      -5.014000      0.6625000    


%chk=000162305-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162305

0 1
O -1.637766 -0.846994 0.374494
O -0.377414 0.500660 -0.981088
O -5.151817 0.040418 -1.727463
O -5.355128 -1.508982 0.757777
O -2.883149 1.740460 -1.988956
O -1.601630 -2.545975 2.774006
O 3.506116 -0.281057 -0.210238
O 0.324952 5.253982 -1.356396
O 1.095169 -2.881885 1.997489
O 5.311287 -1.737908 -0.192545
C -4.133556 0.082653 -0.675456
C -4.059136 -1.243197 0.098270
C -2.807877 0.414379 -1.379483
C -2.877247 -1.219956 1.095132
C -1.670847 0.439684 -0.344372
C -2.594285 -2.598721 1.713603
C 0.451094 1.631312 -0.747373
C 1.780792 1.413342 -0.265075
C -0.030911 2.900818 -1.107801
C 2.654147 2.548691 -0.176612
C 2.210453 0.065020 0.167971
C 0.838395 4.002518 -0.989750
C 2.166234 3.825832 -0.535119
C 4.079966 2.445030 0.337940
C 1.442940 -0.812540 0.907673
C 1.983428 -2.087803 1.268960
C 4.132034 -1.573704 0.175961
C 3.278694 -2.465876 0.925537
C 1.543395 -4.204683 2.465703
H -4.366627 0.904429 0.044002
H -3.947047 -2.082784 -0.610399
H -2.586846 -0.366749 -2.134975
H -3.070847 -0.478733 1.906327
H -1.804401 1.288653 0.363005
H -3.523196 -2.978113 2.172822
H -2.293058 -3.288073 0.895987
H -5.978393 -0.347141 -1.337974
H -5.464918 -0.881019 1.519527
H -3.681422 1.752937 -2.577598
H -0.681972 -2.478567 2.388413
H -1.037245 3.010939 -1.522429
H 2.836123 4.691103 -0.448134
H 4.723726 1.902338 -0.374248
H 4.133534 1.885533 1.288996
H 4.504455 3.449253 0.506115
H 0.418781 -0.568987 1.182375
H 1.017259 5.957011 -1.279583
H 3.716221 -3.428017 1.197551
H 2.418480 -4.102307 3.132392
H 0.685982 -4.610789 3.020930
H 1.790975 -4.856234 1.608309


