%chk=000080521.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080521

0 1
 O  -0.5809000     -0.1961000     -5.7999999E-03
 O   -1.882800       1.722400      8.9999996E-03
 O   -2.768100      -1.618700      5.0000002E-04
 C    1.806300     -0.3813000     -2.0000000E-02
 C    3.131600      0.3753000     -8.3999997E-03
 C   0.6169000      0.5683000     -9.6000005E-03
 C    4.316400     -0.5767000      2.4700001E-02
 C   -1.726900      0.5161000      3.5000001E-03
 C   -2.912400     -0.4093000      6.0000001E-03
 H    1.746900      -1.030900     -0.9023000    
 H    1.743100      -1.049300      0.8483000    
 H    3.177500       1.033900      0.8668000    
 H    3.204500       1.011900     -0.8977000    
 H   0.6487000       1.200300      0.8860000    
 H   0.6397000       1.208100     -0.8999000    
 H    4.290700      -1.204300      0.9213000    
 H    4.318500      -1.230900     -0.8530000    
 H    5.254900     -1.3700000E-02  3.1099999E-02
 H   -3.890300      9.7700000E-02  1.3400000E-02


%chk=000080521-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000080521

0 1
O -0.602316 -0.228428 0.001073
O -1.901606 1.719495 -0.012317
O -2.998616 -1.690534 0.001732
C 1.829562 -0.373309 0.004279
C 3.181225 0.381174 0.002142
C 0.651591 0.597497 -0.000759
C 4.386859 -0.582603 0.006770
C -1.787030 0.468078 -0.004508
C -3.021105 -0.444112 -0.004134
H 1.765219 -1.032643 -0.882123
H 1.763894 -1.025158 0.896116
H 3.235929 1.046670 0.887601
H 3.237093 1.039532 -0.888557
H 0.632045 1.248545 0.893213
H 0.634021 1.241699 -0.899727
H 4.372997 -1.231275 0.902473
H 4.373651 -1.239031 -0.883275
H 5.342838 -0.028511 0.004721
H -3.961951 0.155713 -0.010818


