%chk=000136950.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000136950

0 1
 O  -8.8900000E-02   1.856300      0.3764000    
 O   -2.508400       1.029700     -0.8322000    
 O    1.219300       1.183200       2.102600    
 N    1.769100      0.6856000     -0.1442000    
 C  -0.1860000       1.557400      -1.023200    
 C    1.201200       1.086500      -1.403600    
 C   -1.257000      0.4941000      -1.225600    
 C    1.010600       1.212100      0.8979000    
 C    2.985000     -4.9400002E-02 -4.5200001E-02
 C    3.547100     -0.3151000       1.207300    
 C    3.624900     -0.5113000      -1.199600    
 C   -3.436500      0.1464000     -0.3400000    
 C    4.737600      -1.035300       1.304500    
 C    4.815500      -1.231600      -1.102100    
 C    5.371800      -1.493600      0.1500000    
 C   -3.436700      -1.168600     -0.7876000    
 C   -4.364200      0.5790000      0.5990000    
 C   -4.380500      -2.066000     -0.2879000    
 C   -5.308000     -0.3185000       1.098600    
 C   -5.316000      -1.641100      0.6552000    
 H  -0.4590000       2.475200      -1.555100    
 H    1.167500      0.2741000      -2.135200    
 H    1.800200       1.916100      -1.796300    
 H  -0.9907000     -0.3807000     -0.6176000    
 H   -1.305900      0.2063000      -2.282100    
 H    3.107900      8.8000000E-03   2.141300    
 H    3.234900     -0.3250000      -2.195100    
 H    5.171700      -1.240100       2.278900    
 H    5.311000      -1.587200      -2.000900    
 H    6.299000      -2.054100      0.2256000    
 H   -2.745200      -1.531600      -1.541600    
 H   -4.360800       1.608100      0.9467000    
 H   -4.391500      -3.094100     -0.6379000    
 H   -6.036700      1.2500000E-02   1.832700    
 H   -6.051700      -2.339400       1.043100    


%chk=000136950-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000136950

0 1
O 0.173501 0.799180 1.269083
O -2.548804 0.652550 -0.083805
O 2.117014 0.810621 2.561345
N 2.147836 0.278148 0.224231
C -0.150391 0.679195 -0.181069
C 1.126949 0.069957 -0.818501
C -1.388276 -0.186269 -0.373739
C 1.572759 0.642270 1.456330
C 3.528804 -0.006857 -0.006852
C 4.517964 0.246528 0.983850
C 3.922941 -0.547206 -1.262071
C -3.822549 0.053751 -0.160031
C 5.870581 -0.037722 0.706786
C 5.282091 -0.824058 -1.521656
C 6.266686 -0.571152 -0.541740
C -4.049712 -1.296234 -0.523315
C -4.907652 0.907850 0.153863
C -5.378139 -1.781992 -0.571536
C -6.223365 0.408254 0.100123
C -6.467807 -0.939607 -0.263484
H -0.349949 1.700390 -0.550834
H 1.006980 -1.010729 -1.040389
H 1.392968 0.590887 -1.754303
H -1.344934 -1.059839 0.307792
H -1.431874 -0.545694 -1.425529
H 4.221826 0.648720 1.954426
H 3.182819 -0.759929 -2.039482
H 6.621182 0.162336 1.479484
H 5.566945 -1.240399 -2.494331
H 7.320664 -0.786745 -0.745394
H -3.222059 -1.970812 -0.762812
H -4.697361 1.943496 0.437697
H -5.554645 -2.826933 -0.850436
H -7.060359 1.071253 0.345261
H -7.492034 -1.324510 -0.302164


