%chk=000133257.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133257

0 1
 O    4.826000       1.134300     -0.8402000    
 O    4.529100      -1.926200      -1.052700    
 O   0.4514000       2.813800      4.3299999E-02
 O   -5.025100      -2.701800     -2.5100000E-02
 C    3.150200     -0.3333000      0.1690000    
 C    1.613500     -0.5093000      0.2240000    
 C   0.9355000      0.6294000      0.9815000    
 C    1.411200      -1.944500      0.6983000    
 C    3.427900      0.8868000     -0.7187000    
 C    3.503900      -1.686600     -0.4279000    
 C    2.439400      -2.726600     -0.1279000    
 C    2.738600       2.143000     -0.1636000    
 C    1.283000       1.924900      0.2341000    
 C    3.857000     -0.2567000       1.535500    
 C  -0.5760000      0.4338000       1.070800    
 C   -1.198900      0.3070000     -0.3173000    
 C   -2.688600      9.2600003E-02 -0.2361000    
 C   -3.556900       1.175500     -0.2312000    
 C   -3.168400      -1.208300     -0.1689000    
 C   -4.931900      0.9534000     -0.1573000    
 C   -4.543400      -1.430500     -9.4999999E-02
 C   -3.052400       2.579100     -0.3054000    
 C   -5.425200     -0.3497000     -8.9199997E-02
 H    1.266800     -0.4803000     -0.8215000    
 H    1.327500      0.7206000       2.000100    
 H   0.3984000      -2.314800      0.5125000    
 H    1.609600      -2.046800       1.770600    
 H    3.054900      0.7007000      -1.734200    
 H    2.006500      -3.070300      -1.071800    
 H    2.856500      -3.563400      0.4363000    
 H    2.782300       2.936000     -0.9197000    
 H    3.274500       2.526100      0.7125000    
 H    3.587000      0.6430000       2.095300    
 H    3.632600      -1.120100       2.170500    
 H    4.945800     -0.2467000       1.406600    
 H   -1.022700       1.275800       1.613500    
 H  -0.7990000     -0.4587000       1.669100    
 H  -0.7925000     -0.5603000     -0.8499000    
 H  -0.9750000       1.152900     -0.9719000    
 H    5.235100      0.3322000      -1.207100    
 H   -2.486900      -2.055200     -0.1694000    
 H   -5.633100       1.783700     -0.1524000    
 H   -2.541400       2.759200      -1.256600    
 H   -3.873200       3.302900     -0.2448000    
 H   -2.378000       2.802100      0.5259000    
 H   -6.498600     -0.5094000     -3.1500001E-02
 H   -5.996100      -2.668700      2.1000000E-02


%chk=000133257-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133257

0 1
O 4.925133 1.288731 -0.725457
O 4.818699 -1.728807 -1.100480
O 0.455548 2.835158 0.255015
O -5.314794 -2.648027 0.215482
C 3.220623 -0.321711 0.174778
C 1.686374 -0.579138 0.167604
C 0.904372 0.516413 0.925427
C 1.558003 -2.067365 0.593963
C 3.503180 0.945834 -0.666073
C 3.745289 -1.622205 -0.451494
C 2.731443 -2.748211 -0.173769
C 2.764401 2.154913 -0.056494
C 1.301069 1.905422 0.350927
C 3.861613 -0.232903 1.591322
C -0.630209 0.313136 0.965775
C -1.305331 0.147869 -0.426769
C -2.820384 0.058503 -0.295478
C -3.637795 1.232886 -0.292676
C -3.416898 -1.212453 -0.125405
C -5.033529 1.076158 -0.108898
C -4.810352 -1.340632 0.054369
C -3.051621 2.618713 -0.514110
C -5.632047 -0.191552 0.065806
H 1.370123 -0.530485 -0.899723
H 1.258956 0.521223 1.981349
H 0.579312 -2.502387 0.330377
H 1.683741 -2.175214 1.687371
H 3.121767 0.757572 -1.695873
H 2.401363 -3.158857 -1.147936
H 3.212085 -3.582434 0.368232
H 2.789946 3.017504 -0.743389
H 3.321200 2.464139 0.852215
H 3.423555 0.583197 2.190745
H 3.737029 -1.170877 2.160350
H 4.940171 -0.027727 1.486530
H -1.082584 1.182679 1.476345
H -0.861255 -0.576796 1.582917
H -0.926479 -0.770523 -0.914991
H -1.021585 1.003809 -1.065022
H 5.397453 0.498252 -1.106442
H -2.806209 -2.122219 -0.133649
H -5.671510 1.968082 -0.106013
H -2.744211 2.761503 -1.569196
H -3.796139 3.399894 -0.281761
H -2.152935 2.807461 0.099396
H -6.717783 -0.278165 0.204840
H -6.297894 -2.629762 0.323066


