%chk=000169717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169717

0 1
 O  -0.9798000      -1.115900     -0.7164000    
 O   -3.241800      0.8990000       1.192600    
 O   -1.057900       2.428300     -0.4032000    
 O   -2.910300      -3.162000     -0.4872000    
 O    1.931700       1.590800      -1.703300    
 N    1.051800     -3.0700000E-02 -0.3168000    
 N    3.403300      0.5092000     -0.3557000    
 N    4.906100     -0.6042000       1.026400    
 C   -2.471000      0.5305000      6.5499999E-02
 C   -1.075800       1.111500      0.1175000    
 C   -2.173400     -0.9581000      6.7100003E-02
 C  -0.2993000      0.1485000     -0.7667000    
 C   -3.291200      -1.796300     -0.5264000    
 C    1.308600     -0.9849000      0.6554000    
 C    2.125100      0.7359000     -0.8371000    
 C   -3.384700       2.311700       1.296100    
 C    2.530400      -1.218800       1.130400    
 C    3.628400     -0.3945000      0.5618000    
 H   -2.996100      0.8300000     -0.8516000    
 H  -0.6925000       1.147100       1.144300    
 H   -1.953100      -1.319900       1.079700    
 H  -0.2905000      0.4800000      -1.811700    
 H   -3.465100      -1.531000      -1.574400    
 H   -4.220300      -1.672000      3.8300000E-02
 H   -1.404400       2.404800      -1.311300    
 H   0.4748000      -1.547300       1.057500    
 H   -3.676700       2.758300      0.3404000    
 H   -2.473000       2.771700       1.686700    
 H   -4.182300       2.511000       2.018100    
 H   -3.641700      -3.674200     -0.8723000    
 H    2.736900      -1.955500       1.895300    
 H    5.686000     -6.4700000E-02  0.6664000    
 H    5.113000      -1.298000       1.737300    


%chk=000169717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169717

0 1
O -1.043306 -1.135750 -0.820621
O -3.242795 0.995335 1.160977
O -1.099561 2.452595 -0.849542
O -3.029273 -3.172988 0.184052
O 1.585598 2.088788 -0.760635
N 1.092158 -0.143643 -0.265982
N 3.282270 0.774496 0.192957
N 4.930304 -0.546526 1.151634
C -2.486557 0.591126 -0.012518
C -1.071435 1.203233 -0.122932
C -2.202049 -0.918938 0.104724
C -0.262242 0.093156 -0.871122
C -3.345983 -1.823758 -0.307106
C 1.467811 -1.371703 0.225149
C 2.010942 0.979191 -0.291837
C -3.711594 2.389581 1.089684
C 2.742125 -1.567110 0.728240
C 3.641166 -0.436506 0.686769
H -3.038632 0.830085 -0.949470
H -0.658776 1.328006 0.902201
H -1.901909 -1.157609 1.144880
H -0.111310 0.381612 -1.927617
H -3.449651 -1.805331 -1.411846
H -4.273789 -1.435292 0.163401
H -0.127931 2.691584 -0.967749
H 0.706058 -2.154134 0.173113
H -4.373442 2.538145 0.211856
H -2.864292 3.095238 1.016472
H -4.277357 2.558703 2.018963
H -3.730993 -3.804793 -0.111801
H 3.042113 -2.540269 1.120765
H 5.527767 0.276980 1.095910
H 5.289768 -1.413203 1.541731


