%chk=000115716.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115716

0 1
 O    4.477500      0.7602000      -1.423000    
 O    1.545600     -0.5148000       2.403400    
 O   -2.650900       2.358300      0.4315000    
 O   -2.678200      -2.336100     -0.5145000    
 O   -3.990100      0.1016000     -0.4543000    
 N    2.366700     -7.7900000E-02  0.2567000    
 C    3.766700     -0.3427000      0.6301000    
 C    2.128300      0.2201000      -1.163500    
 C    4.698300      0.6862000     -1.3700000E-02
 C    3.151500       1.211400      -1.699300    
 C    4.157500      -1.774300      0.2519000    
 C    1.361800     -0.2653000       1.212800    
 C  -3.8100000E-02 -0.1693000      0.7774000    
 C  -0.7046000      -1.308100      0.3329000    
 C  -0.6912000       1.060100      0.8109000    
 C   -2.020100       1.151300      0.3972000    
 C   -2.033500      -1.217000     -8.1000000E-02
 C   -2.691400      1.2600000E-02 -4.8799999E-02
 C   -2.563500       3.168700     -0.7388000    
 C   -2.599100      -2.630800      -1.907600    
 C   -4.993200     -9.4200000E-02  0.5398000    
 H    3.865400     -0.2570000       1.718800    
 H    1.120500      0.6044000      -1.333300    
 H    2.213400     -0.7333000      -1.697400    
 H    4.544700       1.680300      0.4244000    
 H    5.746900      0.4168000      0.1509000    
 H    3.046900       1.307500      -2.784500    
 H    3.007400       2.206700      -1.261900    
 H    3.483900      -2.497500      0.7245000    
 H    4.111600      -1.938900     -0.8296000    
 H    5.177300      -1.996400      0.5831000    
 H  -0.1940000      -2.267900      0.3069000    
 H  -0.1701000       1.949200       1.157900    
 H   -3.119000       4.093000     -0.5579000    
 H   -3.008200       2.655400      -1.597200    
 H   -1.520300       3.423000     -0.9521000    
 H   -3.036400      -1.820000      -2.498700    
 H   -3.166000      -3.546400      -2.096900    
 H   -1.558800      -2.794900      -2.206200    
 H   -4.917400      -1.097100      0.9715000    
 H   -5.971900      7.7999998E-03  6.3100003E-02
 H   -4.907700      0.6610000       1.327500    


%chk=000115716-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115716

0 1
O 4.891430 0.139454 -1.453322
O 1.797796 0.830680 2.168907
O -2.816232 2.565481 0.772266
O -2.335868 -2.060211 -0.943995
O -4.029283 0.218836 -0.410845
N 2.561707 -0.178379 0.210868
C 3.925341 -0.342151 0.801066
C 2.474669 -0.422137 -1.246186
C 4.933725 0.491950 -0.020536
C 3.547566 0.407936 -1.984372
C 4.321444 -1.833044 0.882254
C 1.549148 0.355051 1.012115
C 0.127583 0.324840 0.502564
C -0.434242 -0.829182 -0.098723
C -0.688411 1.451594 0.752127
C -2.059317 1.438111 0.413714
C -1.804132 -0.855828 -0.428921
C -2.637966 0.265322 -0.152894
C -3.670649 3.170222 -0.273938
C -2.972095 -1.955775 -2.278088
C -4.772837 -0.648406 0.540006
H 3.860518 0.085640 1.817857
H 1.474694 -0.139798 -1.610778
H 2.631958 -1.497163 -1.461191
H 4.713898 1.574291 0.101330
H 5.968330 0.285714 0.299108
H 3.587862 0.132232 -3.051495
H 3.315084 1.491709 -1.888435
H 3.532678 -2.416009 1.388553
H 4.499302 -2.261696 -0.119841
H 5.254466 -1.942485 1.464434
H 0.158729 -1.730223 -0.282341
H -0.274609 2.333780 1.248009
H -4.185370 4.003757 0.227388
H -4.397438 2.438326 -0.662799
H -3.041236 3.559825 -1.097338
H -3.790783 -1.215248 -2.268019
H -3.361286 -2.962527 -2.492858
H -2.216653 -1.675056 -3.036775
H -4.392613 -1.684612 0.492291
H -5.823744 -0.608096 0.215308
H -4.674963 -0.251023 1.566525


