%chk=000147980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147980

0 1
 O    6.225200      0.5805000      -1.806400    
 O    6.317900      -1.195400     -0.5121000    
 N  -0.3322000      0.7848000      0.8082000    
 N    5.748100     -0.1492000     -0.9048000    
 C   -1.066900     -0.2680000       1.508900    
 C   -1.653300       1.108800       1.345800    
 C   -1.636000      -1.387000      0.6772000    
 C   -2.776600       1.291700      0.3597000    
 C   0.8054000       1.352200       1.506500    
 C   -2.723600      -1.175800     -0.2185000    
 C   -3.308000      0.1969000     -0.3813000    
 C   -1.082100      -2.678500      0.8005000    
 C   -3.321100       2.580100      0.1770000    
 C    2.110100      0.9545000      0.8691000    
 C   -3.200800      -2.291100     -0.9398000    
 C   -4.373500      0.4648000      -1.267500    
 C   -1.574900      -3.755800      7.2300002E-02
 C   -4.369900       2.809900     -0.7066000    
 C   -2.636200      -3.561400     -0.7965000    
 C   -4.896900       1.750600      -1.427600    
 C    2.651800       1.749700     -0.1310000    
 C    2.753200     -0.2004000       1.291400    
 C    3.861100       1.382300     -0.7211000    
 C    3.962600     -0.5678000      0.7014000    
 C    4.516600      0.2235000     -0.3049000    
 H  -0.7302000     -0.5237000       2.510100    
 H   -1.672900       1.726300       2.240200    
 H   0.7282000       2.447900       1.488000    
 H   0.8310000       1.090900       2.573800    
 H  -0.2497000      -2.843400       1.482000    
 H   -2.917100       3.419200      0.7402000    
 H   -4.026700      -2.207300      -1.640100    
 H   -4.829500     -0.3187000      -1.865300    
 H   -1.132100      -4.740500      0.1857000    
 H   -4.772500       3.810600     -0.8287000    
 H   -3.029800      -4.396000      -1.369700    
 H   -5.716700       1.918500      -2.120100    
 H    2.148700       2.653200     -0.4639000    
 H    2.328600     -0.8241000       2.073200    
 H    4.262100       2.023200      -1.502200    
 H    4.444500      -1.477200       1.051200    


%chk=000147980-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147980

0 1
O 5.894726 -1.280289 -1.489406
O 6.914872 -0.342674 0.322119
N -0.389261 0.959985 0.665297
N 5.868984 -0.594516 -0.394758
C -0.988920 -0.329768 1.235100
C -1.717194 0.996308 1.410086
C -1.515757 -1.306799 0.244375
C -2.935492 1.258254 0.596513
C 0.761772 1.504810 1.433827
C -2.604314 -0.950358 -0.614943
C -3.323475 0.346707 -0.436726
C -0.916018 -2.584872 0.150643
C -3.692035 2.426932 0.843981
C 2.087976 0.933813 0.947165
C -3.016050 -1.906898 -1.584775
C -4.457464 0.690445 -1.224337
C -1.345125 -3.519631 -0.813265
C -4.815800 2.745579 0.054851
C -2.396167 -3.167486 -1.691660
C -5.188825 1.872279 -0.992981
C 2.170749 0.187451 -0.255943
C 3.268383 1.168055 1.701042
C 3.407891 -0.317038 -0.702909
C 4.513115 0.675542 1.269152
C 4.564121 -0.065535 0.067083
H -0.472689 -0.750718 2.109380
H -1.694935 1.458414 2.408245
H 0.757611 2.603635 1.283459
H 0.677297 1.332280 2.535573
H -0.092379 -2.837431 0.829450
H -3.383090 3.100934 1.652143
H -3.838977 -1.677786 -2.267919
H -4.789699 0.028301 -2.029076
H -0.865622 -4.501563 -0.885183
H -5.387131 3.660153 0.245883
H -2.736886 -3.877548 -2.453051
H -6.053612 2.107334 -1.623044
H 1.257477 0.018894 -0.833147
H 3.212163 1.741382 2.634228
H 3.493208 -0.894414 -1.627225
H 5.432473 0.846634 1.835051


