%chk=000152798.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152798

0 1
 O    5.824900      -1.181300      0.2715000    
 N    5.110800     -7.1000000E-03  0.1528000    
 N  -0.4379000     -1.1000000E-03 -0.5900000    
 N   -1.017800     -7.9999998E-04  0.5214000    
 C    3.713400     -5.2000000E-03 -3.5900000E-02
 C   0.9553000     -2.2000000E-03 -0.4050000    
 C   -5.169900      3.3000000E-03 -2.6699999E-02
 C    3.020900      -1.212400     -0.1293000    
 C    3.023400       1.203500     -0.1275000    
 C    1.638300      -1.211000     -0.3143000    
 C    1.640800       1.205000     -0.3124000    
 C   -2.404000      6.0000003E-04  0.3377000    
 C   -4.479600      -1.205400      6.3600004E-02
 C   -4.477300       1.210600      6.5200001E-02
 C   -3.096600      -1.206700      0.2459000    
 C   -3.094300       1.209200      0.2474000    
 C   -6.648100      5.5000000E-03 -0.2233000    
 C    5.897700       1.195200      0.2589000    
 H    3.533600      -2.168000     -6.1400000E-02
 H    3.525000       2.164200     -5.9200000E-02
 H    1.106300      -2.155900     -0.3865000    
 H    1.110400       2.151000     -0.3831000    
 H   -5.008000      -2.152500     -4.8000002E-03
 H   -5.004100       2.158800     -2.0000001E-03
 H   -2.567600      -2.153600      0.3164000    
 H   -2.563700       2.155100      0.3192000    
 H   -6.968800      0.8811000     -0.7980000    
 H   -6.974500     -0.8796000     -0.7799000    
 H   -7.155900      1.6799999E-02  0.7463000    
 H    6.959600      0.9590000      0.3931000    
 H    5.590000       1.793600       1.123000    
 H    5.817100       1.802200     -0.6492000    
 H    5.828300      -1.319600       1.234200    


%chk=000152798-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152798

0 1
O 6.002870 -1.142802 -0.041366
N 5.279038 0.067977 0.407532
N -0.367213 -0.519802 0.048721
N -1.110847 0.562979 0.084052
C 3.874907 -0.054492 0.251892
C 1.034179 -0.283459 0.120473
C -5.361167 0.069296 -0.126813
C 3.259228 -1.335021 0.146313
C 3.046157 1.113462 0.278926
C 1.861216 -1.438691 0.081799
C 1.652134 0.997993 0.218411
C -2.518271 0.315685 0.009737
C -4.520897 -1.081640 -0.161149
C -4.747390 1.343739 -0.024125
C -3.122803 -0.971246 -0.094361
C -3.344214 1.468870 0.044075
C -6.870289 -0.076413 -0.193848
C 5.991841 1.263821 -0.081865
H 3.887509 -2.225790 0.087907
H 3.494089 2.108710 0.354268
H 1.375725 -2.416310 -0.007433
H 1.012246 1.885577 0.240847
H -4.982056 -2.074324 -0.242371
H -5.374180 2.242928 0.002439
H -2.475224 -1.852982 -0.121471
H -2.861404 2.448750 0.123331
H -7.372647 0.905658 -0.219610
H -7.180491 -0.639971 -1.093910
H -7.258296 -0.630344 0.682459
H 7.062015 1.146311 0.146212
H 5.622401 2.152389 0.455694
H 5.866114 1.416703 -1.172687
H 6.373418 -1.515260 0.804021


