%chk=000078095.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078095

0 1
 O   -1.081300     -0.4315000      4.0500000E-02
 O    1.731300      0.5907000      -1.808600    
 O  -0.1201000      -1.488900       1.842300    
 C    1.190900      -1.134500     -0.1816000    
 C    2.045000       1.275200      0.4722000    
 C    1.656600      0.2738000     -0.6187000    
 C   0.8209000      -1.958600      -1.427700    
 C    2.355100      -1.824200      0.5455000    
 C  -6.4800002E-02  -1.068100      0.6926000    
 C    1.124900       2.491900      0.4129000    
 C    3.502900       1.688200      0.2989000    
 C   -2.288800     -0.2608000      0.7896000    
 C   -3.308200      0.4505000     -5.4299999E-02
 C   -3.736100     -0.2338000      -1.320500    
 C   -3.828400       1.630100      0.3170000    
 H    1.925600      0.8081000       1.454700    
 H   0.4312000      -2.944400      -1.148100    
 H   5.2800000E-02  -1.464700      -2.034600    
 H    1.692900      -2.113600      -2.073800    
 H    2.114600      -2.870300      0.7678000    
 H    3.267500      -1.808600     -6.1500002E-02
 H    2.587300      -1.342700       1.501300    
 H    1.367800       3.203000       1.209200    
 H    1.210300       3.013400     -0.5468000    
 H   7.7900000E-02   2.194400      0.5323000    
 H    3.667300       2.191200     -0.6605000    
 H    3.811600       2.370800       1.097400    
 H    4.160700      0.8129000      0.3277000    
 H   -2.064800      0.3060000       1.701600    
 H   -2.680200      -1.243800       1.078800    
 H   -4.137800      -1.227500      -1.097300    
 H   -2.886700     -0.3469000      -2.001800    
 H   -4.513500      0.3274000      -1.849800    
 H   -3.523300       2.118000       1.236700    
 H   -4.570800       2.136500     -0.2909000    


%chk=000078095-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078095

0 1
O -0.969870 -0.341430 0.137179
O 1.950049 0.445242 -1.886308
O -0.123611 -1.758367 1.778703
C 1.238445 -1.232912 -0.245470
C 1.835298 1.285545 0.394358
C 1.674080 0.199160 -0.684625
C 0.859382 -2.083608 -1.486787
C 2.423550 -1.882882 0.522556
C 0.018959 -1.160113 0.687956
C 0.948070 2.507009 0.034546
C 3.329192 1.703223 0.486300
C -2.250716 -0.235013 0.920556
C -3.236101 0.544253 0.080438
C -3.547919 -0.020580 -1.290575
C -3.817707 1.667191 0.578009
H 1.514004 0.877856 1.372853
H 0.594468 -3.111902 -1.182516
H 0.010782 -1.634148 -2.028003
H 1.717462 -2.120877 -2.178238
H 2.122291 -2.878242 0.890534
H 3.291025 -1.995334 -0.150882
H 2.725749 -1.285464 1.399697
H 1.080581 3.306597 0.786000
H 1.239646 2.901885 -0.954521
H -0.119950 2.230617 -0.003723
H 3.675500 2.073002 -0.494886
H 3.449827 2.512689 1.228799
H 3.977917 0.860792 0.787555
H -2.030552 0.258446 1.882956
H -2.595786 -1.267004 1.125313
H -3.934043 -1.056293 -1.215600
H -2.630561 -0.064445 -1.906132
H -4.296597 0.591377 -1.820453
H -3.562019 2.060338 1.569216
H -4.570544 2.222594 0.007696


