%chk=000160902.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160902

0 1
 O    3.677000      0.1289000       1.914600    
 O   -6.008700     -0.1110000      0.9496000    
 C    1.551700      0.8316000      8.6599998E-02
 C   0.1379000      0.7230000     -0.5056000    
 C    2.405900     -0.4433000     -0.1208000    
 C  -0.6032000     -0.4874000      0.1512000    
 C   -2.070700     -0.6860000     -0.3997000    
 C    1.692700      -1.590300      0.6155000    
 C   0.2522000      -1.785400      0.1118000    
 C  -0.6820000       2.033200     -0.3828000    
 C    3.755600      4.1800000E-02  0.4890000    
 C    2.461800       1.952500     -0.4100000    
 C    3.887600       1.489900     -4.3900002E-02
 C   -2.064700       1.828600      -1.015800    
 C   -2.810600      0.6567000     -0.4205000    
 C    2.590100     -0.8239000      -1.618500    
 C   -2.810800      -1.684400      0.5385000    
 C   -2.076100      -1.253900      -1.838000    
 C  -0.8159000       2.578600       1.045700    
 C   -4.319400      -1.696700      0.3473000    
 C   -4.064900      0.8322000      2.7799999E-02
 C    4.920900     -0.7781000      0.1322000    
 C   -4.879400     -0.3083000      0.5056000    
 C    5.873000      -1.448200     -0.1598000    
 H    1.429600      0.9844000       1.170000    
 H   0.2337000      0.5281000      -1.580100    
 H  -0.6977000     -0.2429000       1.219900    
 H    1.653800      -1.390500       1.693500    
 H    2.251600      -2.526200      0.4958000    
 H   0.2831000      -2.193500     -0.9028000    
 H  -0.2139000      -2.555900      0.7361000    
 H  -0.1725000       2.808700     -0.9703000    
 H    2.226200       2.911500      6.2199999E-02
 H    2.374000       2.089700      -1.493800    
 H    4.518800       1.548400     -0.9391000    
 H    4.319900       2.164500      0.7044000    
 H   -1.946100       1.654700      -2.093100    
 H   -2.645300       2.756100     -0.9290000    
 H    3.139300     -6.2899999E-02  -2.181800    
 H    3.146400      -1.763600      -1.713400    
 H    1.642200     -0.9750000      -2.140800    
 H   -2.604700      -1.422700       1.585900    
 H   -2.435000      -2.704200      0.3944000    
 H   -1.429700     -0.6819000      -2.511000    
 H   -1.736900      -2.294900      -1.862800    
 H   -3.082100      -1.238600      -2.273800    
 H   0.1583000       2.845800       1.464700    
 H   -1.423400       3.490600       1.048900    
 H   -1.291700       1.865200       1.724500    
 H   -4.772000      -2.342900       1.107600    
 H   -4.602100      -2.080400     -0.6379000    
 H   -4.550400       1.802100      7.0000002E-03
 H    4.504400      0.5210000       2.243100    
 H    6.717300      -2.042900     -0.4195000    


%chk=000160902-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000160902

0 1
O 3.518866 0.097446 1.946990
O -6.098033 -0.124228 1.051229
C 1.549069 0.857083 0.025850
C 0.129056 0.737135 -0.562815
C 2.406238 -0.433212 -0.169817
C -0.595297 -0.475187 0.110949
C -2.084124 -0.693143 -0.393980
C 1.706508 -1.606283 0.550202
C 0.256171 -1.776937 0.023642
C -0.691140 2.055604 -0.415513
C 3.758847 0.052809 0.472968
C 2.475567 1.999600 -0.461435
C 3.916521 1.519946 -0.078345
C -2.104905 1.834031 -1.021938
C -2.826008 0.655785 -0.396711
C 2.664969 -0.780663 -1.660236
C -2.796926 -1.687039 0.577181
C -2.122679 -1.259720 -1.851289
C -0.792449 2.595155 1.032136
C -4.333051 -1.709945 0.434586
C -4.099561 0.803490 0.094231
C 4.928649 -0.799629 0.208736
C -4.932226 -0.312637 0.583629
C 5.928452 -1.499890 0.037004
H 1.443268 0.973751 1.123708
H 0.214564 0.539933 -1.654113
H -0.676410 -0.224005 1.191760
H 1.697026 -1.402456 1.636033
H 2.266853 -2.550069 0.398792
H 0.287797 -2.132245 -1.023944
H -0.233174 -2.577810 0.609103
H -0.185380 2.831060 -1.027737
H 2.227882 2.968982 0.005390
H 2.388934 2.132606 -1.556983
H 4.599496 1.540653 -0.945646
H 4.367659 2.151212 0.708140
H -1.988461 1.644438 -2.110616
H -2.717318 2.749395 -0.920395
H 3.183940 0.030579 -2.200765
H 3.295557 -1.684886 -1.731949
H 1.723887 -0.985699 -2.197620
H -2.545199 -1.401277 1.618788
H -2.401403 -2.707294 0.419246
H -1.524769 -0.646286 -2.548238
H -1.727141 -2.289864 -1.880588
H -3.158083 -1.285010 -2.235563
H 0.203044 2.799854 1.464022
H -1.363296 3.542492 1.044468
H -1.316100 1.889647 1.702172
H -4.799843 -2.376806 1.181065
H -4.626294 -2.097185 -0.562828
H -4.581526 1.790125 0.095827
H 4.382255 0.293103 2.392814
H 6.794822 -2.114609 -0.122800


