%chk=000076983.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076983

0 1
 O  -0.9699000       2.871200     -0.1805000    
 N   4.0500000E-02  0.7730000      7.6700002E-02
 N    4.391100      -1.403600      0.2133000    
 N   -4.056000      -1.823100     -0.3238000    
 C    1.226100      5.5000000E-02  0.5133000    
 C   -1.064900     -1.3800000E-02 -0.4431000    
 C    2.239900     -0.1323000     -0.6091000    
 C   -2.046400     -0.4295000      0.6459000    
 C  -3.2900002E-02   2.154200      0.1530000    
 C    3.441900     -0.8428000     -0.1486000    
 C   -3.169300      -1.208300      0.1031000    
 H   0.9240000     -0.9093000      0.9394000    
 H    1.692000      0.6262000       1.326700    
 H  -0.6649000     -0.8883000     -0.9705000    
 H   -1.593500      0.5900000      -1.191900    
 H    1.783100     -0.6890000      -1.435900    
 H    2.527800      0.8444000      -1.016300    
 H   -1.528600      -1.022300       1.409000    
 H   -2.433900      0.4602000       1.156700    
 H   0.8920000       2.591400      0.5644000    


%chk=000076983-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076983

0 1
O -1.153447 2.735034 -0.006991
N 0.074945 0.747800 0.146862
N 4.481257 -1.448403 0.085618
N -4.034252 -1.905360 -0.401935
C 1.325684 0.086489 0.548176
C -1.025470 -0.042234 -0.441853
C 2.267199 -0.173607 -0.670886
C -2.149990 -0.313776 0.605029
C -0.101331 2.116723 0.310784
C 3.495012 -0.877954 -0.268658
C -3.198021 -1.190119 0.059704
H 1.099894 -0.873887 1.046643
H 1.850243 0.721566 1.284122
H -0.621322 -0.996030 -0.822322
H -1.457562 0.520828 -1.286996
H 1.741730 -0.776693 -1.435274
H 2.534799 0.789127 -1.144514
H -1.723872 -0.784107 1.511219
H -2.595329 0.652679 0.903191
H 0.787931 2.615224 0.759881


