%chk=000052684.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052684

0 1
 O   0.8472000      -1.505500      -1.336500    
 N    2.691500      -1.340900      0.1115000    
 C    1.430600      0.2626000      0.4089000    
 C    2.765400     -0.1990000       1.007900    
 C   0.2644000      0.2387000       1.393600    
 C    1.475900       1.568100     -0.3390000    
 C    1.515900     -0.9877000     -0.4719000    
 C   -1.055700      0.1367000      0.7071000    
 C    2.750600       1.715100      -1.162300    
 C   -1.739800       1.294200      0.3354000    
 C   -1.606200      -1.116100      0.4362000    
 C   -2.974400       1.198900     -0.3068000    
 C   -2.840800      -1.211300     -0.2062000    
 C   -3.524700     -5.3700000E-02 -0.5777000    
 H    3.668800      0.3934000      0.8616000    
 H    2.735500     -0.5076000       2.058800    
 H   0.2874000       1.124300       2.042900    
 H   0.3610000     -0.6113000       2.083900    
 H    1.416600       2.420200      0.3492000    
 H   0.6298000       1.653000      -1.030000    
 H    3.290300      -2.137500     -5.6400001E-02
 H    3.629400       1.905300     -0.5406000    
 H    2.946500      0.8486000      -1.800400    
 H    2.652400       2.585200      -1.821800    
 H   -1.327800       2.277400      0.5463000    
 H   -1.089800      -2.027100      0.7268000    
 H   -3.507900       2.100000     -0.5946000    
 H   -3.270300      -2.186600     -0.4155000    
 H   -4.486300     -0.1279000      -1.077200    


%chk=000052684-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052684

0 1
O 1.464111 -2.105876 -0.863306
N 3.096325 -1.221062 0.685475
C 1.508609 0.184177 0.442486
C 2.848448 0.117163 1.288693
C 0.247897 0.212641 1.356330
C 1.470172 1.273965 -0.656190
C 1.931190 -1.248612 -0.079485
C -1.114548 0.223568 0.665185
C 2.647574 1.246974 -1.654209
C -2.082939 1.188963 1.043002
C -1.462910 -0.736901 -0.322757
C -3.370307 1.198873 0.458500
C -2.747902 -0.725564 -0.909352
C -3.708106 0.238450 -0.521551
H 3.604707 0.877202 1.028091
H 2.696914 0.091244 2.382668
H 0.325332 1.116026 1.994274
H 0.304736 -0.658088 2.042525
H 1.418177 2.263667 -0.156544
H 0.523203 1.159207 -1.215326
H 3.855454 -1.895655 0.799453
H 3.626452 1.366699 -1.153782
H 2.667852 0.296683 -2.217410
H 2.547174 2.069363 -2.385458
H -1.828213 1.938403 1.803605
H -0.725251 -1.483480 -0.639359
H -4.104336 1.952561 0.766243
H -2.999730 -1.472732 -1.670781
H -4.704581 0.241644 -0.977820


