%chk=000160681.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160681

0 1
 O  -0.5017000      -1.844700       1.602000    
 O    2.413900      -1.248700      1.3900000E-02
 N   -1.033300       1.112500      0.3375000    
 N   0.9397000       2.028800     -3.1599998E-02
 N  -0.8199000      -2.050900     -0.6856000    
 N    3.463000      0.7957000     -0.2969000    
 C   -2.473100       1.024000      0.5567000    
 C  -0.1596000      7.4500002E-02  0.2989000    
 C   -3.244900      0.8682000     -0.7516000    
 C    1.060400      0.6654000      6.8099998E-02
 C  -0.3426000       2.264600      0.1361000    
 C   -4.742400      0.7893000     -0.5049000    
 C  -0.4872000      -1.306300      0.4664000    
 C    2.323000      8.9999998E-04 -6.0199998E-02
 C   -1.194600      -3.446800     -0.6775000    
 C    4.799400      0.2737000     -0.4713000    
 H   -2.659500      0.1818000       1.232200    
 H   -2.775800       1.937900       1.081500    
 H   -2.919000     -3.4899998E-02  -1.280000    
 H   -3.032300       1.714700      -1.415700    
 H  -0.8108000       3.239400      0.1187000    
 H   -4.990600     -6.9799997E-02  0.1266000    
 H   -5.277800      0.6798000      -1.453200    
 H   -5.107000       1.696000     -1.1500000E-02
 H  -0.8267000      -1.571600      -1.581400    
 H    3.339700       1.800700     -0.3811000    
 H  -0.7780000      -3.952900      0.1965000    
 H  -0.8208000      -3.910300      -1.593300    
 H   -2.285400      -3.507400     -0.6533000    
 H    4.901200     -0.6982000      1.7300000E-02
 H    5.507400      0.9856000     -4.1000001E-02
 H    4.988500      0.1691000      -1.542400    


%chk=000160681-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000160681

0 1
O -2.187046 -1.630261 0.266731
O 2.400412 -1.420367 -0.632789
N -1.151862 1.068316 0.407703
N 0.945137 1.871891 0.118177
N -0.061799 -2.436923 -0.279842
N 3.290260 0.731026 -0.490776
C -2.618573 1.139956 0.640862
C -0.353689 -0.050769 0.090851
C -3.425749 1.181571 -0.674785
C 0.952093 0.481389 -0.081587
C -0.328740 2.183837 0.406221
C -4.938494 1.288436 -0.390670
C -0.939567 -1.433683 0.032609
C 2.251350 -0.159427 -0.421295
C -0.501382 -3.832087 -0.362270
C 4.661308 0.336540 -0.811092
H -2.916619 0.256343 1.224084
H -2.800653 2.056253 1.234218
H -3.217604 0.255149 -1.238280
H -3.089854 2.038123 -1.292108
H -0.700940 3.182296 0.622195
H -5.291569 0.415948 0.188851
H -5.512482 1.320362 -1.333652
H -5.182495 2.202963 0.182997
H 0.946851 -2.193448 -0.453136
H 3.039872 1.709245 -0.300154
H -1.581294 -3.876438 -0.149347
H 0.038542 -4.456636 0.373800
H -0.313141 -4.241640 -1.372246
H 4.673715 -0.751761 -0.980519
H 5.349334 0.577631 0.020415
H 5.017878 0.846267 -1.725267


