%chk=000150030.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150030

0 1
 O   -2.529500      -2.761100     -0.4101000    
 N  -0.6866000       1.508500     -0.4800000    
 N   -2.937400       1.287100     -5.7700001E-02
 N   -5.127600      -1.361100      0.1876000    
 N   -1.563200     -0.6653000     -0.4564000    
 N   -5.288600      0.8616000      0.3688000    
 C    4.782400      0.4847000      0.7190000    
 C    5.349900     -0.6816000     -0.1042000    
 C    3.349400      0.7532000      0.4048000    
 C    6.806700     -0.9736000      0.2548000    
 C    3.013600       1.652300     -0.6074000    
 C    2.344900      0.1050000       1.123400    
 C   0.6513000       1.258600     -0.1861000    
 C    1.673200       1.903500     -0.9009000    
 C    1.004600      0.3559000      0.8298000    
 C    7.349300      -2.154600     -0.5342000    
 C   -1.737300      0.6349000     -0.3348000    
 C   -4.007100      0.4884000      9.5500000E-02
 C   -3.870300     -0.8711000     -2.2700001E-02
 C   -2.633000      -1.544400     -0.3079000    
 C   -5.944400     -0.2811000      0.4187000    
 H    5.377800       1.389300      0.5393000    
 H    4.890600      0.2703000       1.790300    
 H    5.274400     -0.4512000      -1.174600    
 H    4.745200      -1.581500      6.6900000E-02
 H    7.423100     -8.9900002E-02  5.3300001E-02
 H    6.889700      -1.190100       1.326200    
 H    3.787000       2.162000      -1.175900    
 H    2.593800     -0.5952000       1.916400    
 H    1.427000       2.606100      -1.693800    
 H   0.2472000     -0.1485000       1.424500    
 H    7.308300      -1.959200      -1.610500    
 H    6.773900      -3.062500     -0.3273000    
 H    8.392500      -2.344500     -0.2628000    
 H  -0.8861000       2.445600     -0.8163000    
 H   -2.971600       2.298100      1.9800000E-02
 H   -5.408000      -2.332800      0.1763000    
 H   -7.000600     -0.3989000      0.6152000    


%chk=000150030-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150030

0 1
O -3.028028 -2.340466 1.624292
N -0.679165 1.236923 -0.430946
N -3.012766 1.136726 -0.667885
N -5.585235 -1.031361 0.416713
N -1.843693 -0.563547 0.604989
N -5.487467 0.878045 -0.824297
C 4.905052 0.309032 0.862247
C 5.578240 -0.628608 -0.179579
C 3.433574 0.554615 0.567712
C 7.076310 -0.870970 0.111672
C 3.019393 1.650037 -0.233049
C 2.429358 -0.326660 1.042568
C 0.671698 0.953174 -0.063939
C 1.661641 1.850979 -0.547086
C 1.062953 -0.147201 0.741755
C 7.742228 -1.808273 -0.918889
C -1.844913 0.547634 -0.126863
C -4.218371 0.497384 -0.408188
C -4.233622 -0.675264 0.360268
C -3.030417 -1.283264 0.923138
C -6.296237 -0.080832 -0.299016
H 5.455125 1.271037 0.878838
H 5.021057 -0.142262 1.867577
H 5.461563 -0.190999 -1.191967
H 5.039896 -1.597762 -0.196542
H 7.607442 0.103061 0.125898
H 7.185829 -1.299231 1.129208
H 3.768239 2.356282 -0.612027
H 2.718672 -1.178707 1.670403
H 1.368941 2.710248 -1.166642
H 0.296991 -0.830408 1.112496
H 7.666515 -1.390964 -1.940805
H 7.253170 -2.800594 -0.926078
H 8.813954 -1.961206 -0.694402
H -0.783671 2.072274 -1.010540
H -3.009002 1.997041 -1.218943
H -5.945190 -1.850468 0.906733
H -7.375564 -0.108546 -0.421825


