%chk=000170718.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170718

0 1
 O  -0.6545000      -2.279200      0.1089000    
 O  -0.2094000      -1.705600       2.324700    
 O    4.144800       1.634100     -0.9000000    
 O   -1.313800      -3.010600      -1.923100    
 O   0.7758000       3.649900      0.1737000    
 O    2.386400       3.574900      -1.456000    
 C  -0.4300000      -1.157600       1.013600    
 C   -1.666400     -0.2887000       1.129600    
 C   0.8345000     -0.4573000      0.5013000    
 C   -2.624600     -0.3163000      0.1063000    
 C    2.053800      -1.138900      0.3455000    
 C   -2.504800      -1.203600     -0.9689000    
 C   -3.728700      0.5720000      0.1509000    
 C   -1.831000      0.5998000       2.207300    
 C   0.7364000      0.9004000      0.1910000    
 C    3.185900     -0.4353000     -0.1303000    
 C   -1.433800      -2.220600     -0.9965000    
 C    1.849600       1.592400     -0.2768000    
 C    3.067100      0.9301000     -0.4371000    
 C   -3.869200       1.445800       1.238200    
 C   -3.443300      -1.193200      -2.008500    
 C   -2.928300       1.454500       2.263800    
 C   -4.663100      0.5659000     -0.8953000    
 C    2.172600      -2.504200      0.6520000    
 C   -4.515600     -0.3061000      -1.971600    
 C    4.403300      -1.117700     -0.2855000    
 C    3.390100      -3.166400      0.4920000    
 C    4.503300      -2.474500      2.4100000E-02
 C    1.717900       3.008900     -0.5905000    
 C   0.5949000       5.047200     -8.2900003E-02
 H   -1.091100      0.6471000       3.002800    
 H  -0.1981000       1.442600      0.2661000    
 H   -4.712200       2.131100       1.294100    
 H   -3.364000      -1.879000      -2.847900    
 H   -3.041600       2.138700       3.099600    
 H   -1.065800      -1.861500       2.757100    
 H   -5.514500       1.243200     -0.8824000    
 H    1.356300      -3.106100       1.035100    
 H   -5.244800     -0.3022000      -2.776600    
 H    5.293000     -0.6080000     -0.6485000    
 H    3.470600      -4.221800      0.7358000    
 H    5.451000      -2.990500     -9.9399999E-02
 H    3.950600       2.582800     -0.9500000    
 H   0.2648000       5.202100      -1.114300    
 H  -0.1792000       5.419100      0.5935000    
 H    1.524100       5.590600      0.1128000    


%chk=000170718-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170718

0 1
O -0.720689 -2.368738 0.056951
O -0.122915 -1.911365 2.281174
O 4.232636 1.639749 -0.734566
O -1.493042 -3.062859 -1.978976
O 0.516959 3.606138 -0.348959
O 2.772562 3.736072 -0.897490
C -0.448869 -1.232928 1.049796
C -1.694176 -0.367811 1.214930
C 0.801481 -0.488831 0.577750
C -2.651180 -0.273421 0.154433
C 2.074057 -1.184078 0.414943
C -2.552489 -1.102101 -1.014694
C -3.746904 0.664087 0.263549
C -1.860315 0.395562 2.376918
C 0.719767 0.865530 0.275392
C 3.232544 -0.436446 -0.025067
C -1.562095 -2.214490 -1.063961
C 1.851727 1.617283 -0.176591
C 3.109628 0.969288 -0.317382
C -3.881999 1.437588 1.462401
C -3.465842 -0.954437 -2.067884
C -2.965414 1.291184 2.506339
C -4.663142 0.787536 -0.831953
C 2.246467 -2.584570 0.660517
C -4.514149 0.007455 -1.983384
C 4.498072 -1.082291 -0.183355
C 3.492694 -3.198766 0.494128
C 4.630775 -2.447949 0.075690
C 1.769036 3.041073 -0.499483
C 0.410624 5.047119 -0.684733
H -1.117010 0.318653 3.176788
H -0.222135 1.407514 0.381911
H -4.716109 2.143732 1.548282
H -3.370357 -1.611818 -2.938071
H -3.076206 1.877942 3.424027
H -0.921409 -2.419840 2.581568
H -5.488927 1.504282 -0.751826
H 1.386195 -3.173348 0.976377
H -5.217358 0.113861 -2.815598
H 5.347268 -0.478525 -0.514896
H 3.593051 -4.272833 0.685389
H 5.599964 -2.942802 -0.047111
H 3.965991 2.619602 -0.904460
H 0.685578 5.212462 -1.739505
H -0.644114 5.295601 -0.503766
H 1.078769 5.639236 -0.037843


