%chk=000001446.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001446

0 1
 O    1.704900       3.310700       1.082800    
 O   -5.390200      0.2069000       1.220900    
 C    3.605000      -1.582500      0.4806000    
 C    4.801100     -0.6816000      0.1465000    
 C    3.011400      -2.282400     -0.7466000    
 C    4.490600      0.5133000     -0.7614000    
 C    1.872200      -3.244400     -0.3919000    
 C    3.510400       1.473000     -0.1503000    
 C   0.6889000      -2.552900      0.2196000    
 C    2.362600       1.839400     -0.7424000    
 C    1.332800       2.786400     -0.1867000    
 C   0.1746000      -2.868200       1.413500    
 C   4.8799999E-02   2.085900     -5.5900000E-02
 C  -0.9983000       1.507600      4.9500000E-02
 C   -4.483500     -0.5092000      0.3884000    
 C   -2.188200      0.8355000      0.1669000    
 C   -3.224600      0.2374000      0.2683000    
 C   -5.063900     -0.7478000     -0.9783000    
 C   -6.254700     -0.3272000      -1.423300    
 H    2.837800     -0.9944000      0.9963000    
 H    3.942300      -2.345400       1.193600    
 H    5.229300     -0.3144000       1.088200    
 H    5.582200      -1.288000     -0.3292000    
 H    3.800000      -2.847700      -1.258100    
 H    2.639100      -1.539000      -1.461100    
 H    4.148700      0.1641000      -1.742100    
 H    5.424700       1.059700     -0.9422000    
 H    2.252900      -4.029800      0.2725000    
 H    1.538000      -3.744500      -1.308800    
 H    3.772900       1.877900      0.8232000    
 H   0.2198000      -1.760400     -0.3575000    
 H    2.138800       1.425500      -1.725000    
 H    1.234800       3.631300     -0.8775000    
 H  -0.6882000      -2.334500       1.797200    
 H   0.6006000      -3.655400       2.025400    
 H    1.045100       3.981000       1.330900    
 H   -4.300400      -1.477300      0.8662000    
 H   -4.455700      -1.337100      -1.663000    
 H   -5.485100       1.109100      0.8694000    
 H   -6.574300     -0.5680000      -2.431800    
 H   -6.931900      0.2556000     -0.8102000    


%chk=000001446-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001446

0 1
O 2.254791 3.339818 1.363913
O -5.515097 0.754486 0.123714
C 3.239044 -1.676219 0.286749
C 4.613157 -0.990237 0.089804
C 2.513416 -2.034983 -1.029257
C 4.562863 0.360851 -0.684282
C 1.196758 -2.831024 -0.802078
C 3.662075 1.381761 -0.023765
C 0.154947 -2.041388 -0.034566
C 2.612568 1.985441 -0.632215
C 1.685370 2.988068 0.046410
C -0.487699 -2.458128 1.086242
C 0.326539 2.417489 0.169415
C -0.790383 1.880899 0.261525
C -4.368937 -0.077689 0.540711
C -2.004273 1.253664 0.367382
C -3.090637 0.658263 0.456602
C -4.281712 -1.404053 -0.224031
C -5.277368 -1.880203 -1.007648
H 2.582882 -1.023408 0.894510
H 3.386141 -2.603942 0.877837
H 5.068328 -0.810723 1.085142
H 5.297281 -1.676216 -0.451009
H 3.188623 -2.633597 -1.674973
H 2.277149 -1.108434 -1.590120
H 4.240344 0.190780 -1.729254
H 5.596427 0.762651 -0.734859
H 1.417215 -3.777583 -0.269995
H 0.781726 -3.108780 -1.794392
H 3.871431 1.639954 1.023310
H -0.076108 -1.041682 -0.436714
H 2.356598 1.763724 -1.677323
H 1.620896 3.906240 -0.581503
H -1.220476 -1.820599 1.595079
H -0.283096 -3.437815 1.536736
H 1.560822 3.809198 1.893332
H -4.592605 -0.284637 1.606334
H -3.344005 -1.961261 -0.092139
H -5.370069 1.027671 -0.819918
H -5.174337 -2.836789 -1.530378
H -6.219287 -1.333369 -1.127730


