%chk=000128452.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128452

0 1
 O    1.788600       1.828900     -0.7216000    
 O    4.380000      7.1999997E-02  0.4570000    
 O    2.820000      -2.810000     -0.4014000    
 O  -0.6726000       2.509000     -0.4485000    
 O   -2.133200      -2.581600      0.2663000    
 O   -4.609100      -1.894200      0.5412000    
 C   4.9999999E-03  0.2471000     -0.3145000    
 C  -0.3910000      -1.078900     -0.1270000    
 C    1.354800      0.5485000     -0.5321000    
 C    2.302000     -0.4755000     -0.5619000    
 C   -2.807700     -0.3206000      0.1316000    
 C   -2.411800       1.005300     -5.6100000E-02
 C  -0.9910000       1.337600     -0.2860000    
 C   -1.811600      -1.411100      0.1037000    
 C   0.5627000      -2.103400     -0.1574000    
 C    1.906700      -1.798500     -0.3750000    
 C    3.745700     -0.1591000     -0.7932000    
 C   -4.157700     -0.6223000      0.3476000    
 C   -3.365800       2.029500     -2.7600000E-02
 C   -5.105200      0.4014000      0.3749000    
 C   -4.710000       1.724500      0.1879000    
 C    5.758500      0.3779000      0.2944000    
 C    2.167300       2.560700      0.4410000    
 C    6.375400      0.6128000       1.656700    
 H   0.2671000      -3.139700     -1.2800000E-02
 H    4.243900     -0.9854000      -1.315600    
 H    3.858000      0.7185000      -1.441700    
 H   -3.085300       3.069500     -0.1706000    
 H   -6.157300      0.1850000      0.5420000    
 H   -5.449400       2.519900      0.2099000    
 H    6.267300     -0.4558000     -0.2020000    
 H    5.868000       1.278700     -0.3199000    
 H    2.363500      -3.655900     -0.2535000    
 H    1.663300       2.197600       1.343400    
 H    1.897900       3.609800      0.2890000    
 H    3.250400       2.502700      0.5761000    
 H   -5.572600      -1.881800      0.6725000    
 H    7.438900      0.8520000       1.568600    
 H    5.869400       1.436100       2.171800    
 H    6.263700     -0.2744000       2.288700    


%chk=000128452-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128452

0 1
O 1.901312 1.802572 -0.700791
O 4.417916 0.153405 0.432335
O 2.799651 -2.897842 -0.572367
O -0.686379 2.596763 0.008481
O -2.141149 -2.702461 0.356540
O -4.718786 -1.967674 0.407614
C 0.010818 0.279182 -0.163311
C -0.416068 -1.081461 -0.050713
C 1.401354 0.526304 -0.438401
C 2.330608 -0.540889 -0.574118
C -2.870896 -0.392065 0.183923
C -2.448845 0.970716 0.069210
C -0.992793 1.360354 -0.031198
C -1.854925 -1.475830 0.185279
C 0.500921 -2.140460 -0.176398
C 1.859776 -1.870969 -0.434227
C 3.784859 -0.252947 -0.847344
C -4.274727 -0.652587 0.295975
C -3.387652 2.026251 0.069492
C -5.207660 0.416223 0.287308
C -4.765012 1.747349 0.174553
C 5.861748 0.391471 0.262483
C 2.239303 2.661065 0.460717
C 6.425889 0.784471 1.627510
H 0.114486 -3.161697 -0.072133
H 4.289517 -1.158494 -1.235861
H 3.874922 0.576277 -1.577773
H -3.010492 3.049129 -0.010829
H -6.280587 0.197679 0.370603
H -5.495521 2.562784 0.169334
H 6.349166 -0.533637 -0.118590
H 6.025211 1.198260 -0.487094
H 2.377607 -3.782928 -0.437734
H 1.331499 2.885722 1.043932
H 2.632689 3.588600 0.018318
H 3.014013 2.154263 1.063857
H -5.709149 -1.990918 0.468101
H 7.514168 0.965646 1.558511
H 5.941133 1.704543 1.998091
H 6.248878 -0.019370 2.362616


