%chk=000126220.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126220

0 1
 O    2.042900     -0.4649000     -0.9605000    
 O    1.133500       2.237800       1.227800    
 O    3.371200       2.202400     -0.3137000    
 O    3.860800      -2.526100     -0.4040000    
 O   -4.363600      -1.105100       1.176600    
 N  -0.1969000     -0.2746000     -0.2007000    
 N   -1.866000       1.451400     -0.5991000    
 N   -1.613500      -1.961100      0.2384000    
 N   -4.178700      0.7804000     -0.3999000    
 C    1.065500      0.4332000     -0.4008000    
 C    1.678300      0.9816000      0.8789000    
 C    3.145400       1.054100      0.5038000    
 C    3.325700     -0.1988000     -0.3475000    
 C    3.729500      -1.418200      0.4694000    
 C   -1.454800      0.2156000     -0.2972000    
 C  -0.3449000      -1.604400      0.1274000    
 C   -2.309000     -0.8150000     -2.5599999E-02
 C   -3.789000     -0.6294000     -4.3800000E-02
 C   -3.236300       1.641100     -0.6295000    
 H   0.8753000       1.219200      -1.141600    
 H    1.533000      0.2909000       1.717600    
 H    3.812200       1.121700       1.368100    
 H    4.038000     -4.6799999E-02  -1.166300    
 H    2.978800      -1.676300       1.222900    
 H    4.689300      -1.257500      0.9690000    
 H   0.5010000      -2.261600      0.2764000    
 H    1.310800       2.855600      0.4983000    
 H    4.308200       2.193100     -0.5740000    
 H   -4.195900      -1.262200     -0.8418000    
 H   -1.232300       2.218800     -0.7986000    
 H    3.003000      -2.656200     -0.8435000    
 H   -3.499100       2.678900     -0.8899000    
 H   -4.144100      -2.049300       1.256500    


%chk=000126220-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126220

0 1
O 2.214805 -0.732743 -0.929254
O 0.934518 2.526358 0.209086
O 3.393080 2.197794 -0.583475
O 3.754580 -2.621169 0.548252
O -3.969565 -1.258629 1.390543
N -0.143680 -0.446703 -0.715751
N -1.669615 1.412406 0.078460
N -1.736493 -2.073853 -0.901515
N -4.020474 0.794233 0.213528
C 1.133870 0.258611 -0.865849
C 1.464105 1.180837 0.349764
C 3.012720 1.153782 0.384085
C 3.366562 -0.270385 -0.082003
C 3.538857 -1.277362 1.070153
C -1.361757 0.110175 -0.306276
C -0.438269 -1.782442 -1.085654
C -2.323682 -0.894098 -0.412317
C -3.733682 -0.652830 0.041314
C -3.041213 1.661877 0.277541
H 1.138080 0.853065 -1.802322
H 1.038230 0.756363 1.273575
H 3.416313 1.384740 1.388436
H 4.259670 -0.293037 -0.732344
H 2.656851 -1.243949 1.746350
H 4.446922 -1.041939 1.652641
H 0.329570 -2.452805 -1.457413
H 1.606190 3.043131 -0.318011
H 4.364027 2.374569 -0.560852
H -4.481918 -1.074496 -0.657977
H -0.953264 2.150964 0.136003
H 2.992383 -2.842102 -0.047785
H -3.283611 2.712421 0.478681
H -3.925810 -2.244484 1.273487


