%chk=000086370.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086370

0 1
 O   -1.381500       2.435300      0.1995000    
 N   -1.388700      0.2006000     -0.4011000    
 N   -3.306700       1.221900      0.4414000    
 N   -3.959400      3.4899998E-02  0.5295000    
 N  -6.7199998E-02  0.2117000     -0.7036000    
 N    4.112500      0.1234000      -1.156200    
 C   -2.176900     -0.8958000     -0.8934000    
 C   -3.409200     -0.9916000     -3.8800001E-02
 C   -1.977000       1.363400      7.1300000E-02
 C   -4.091000      -2.329300      6.0400002E-02
 C   0.6818000     -0.1076000      0.3032000    
 C    2.131300     -0.1541000      0.1990000    
 C    2.916500     -0.5023000       1.291500    
 C    2.770900      0.1472000     -0.9918000    
 C    4.300400     -0.5380000       1.161500    
 C    4.844300     -0.2196000     -7.2400004E-02
 H   -1.602100      -1.824800     -0.8343000    
 H   -2.470200     -0.6962000      -1.928500    
 H   -4.458000      -2.619700     -0.9277000    
 H   -4.932200      -2.283700      0.7573000    
 H   -3.375900      -3.077300      0.4129000    
 H   -3.816800       2.011700      0.8238000    
 H   0.2434000     -0.3602000       1.287300    
 H    2.464700     -0.7478000       2.248800    
 H    2.224700      0.4276000      -1.887100    
 H    4.933300     -0.8066000       1.999500    
 H    5.918300     -0.2325000     -0.2258000    


%chk=000086370-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086370

0 1
O -1.325745 1.614886 1.799114
N -1.416609 -0.065001 0.118363
N -3.381674 0.736140 1.140259
N -4.205715 -0.279623 0.620273
N -0.062401 -0.308526 -0.101610
N 3.981803 -1.332322 -0.923306
C -2.275895 -0.761233 -0.874409
C -3.668957 -1.022744 -0.324027
C -1.980069 0.824320 1.055649
C -4.484865 -2.138124 -0.919248
C 0.888065 0.308634 0.579336
C 2.292586 -0.029685 0.301881
C 3.324575 0.641358 1.012801
C 2.686616 -1.011337 -0.656215
C 4.672082 0.318945 0.747506
C 4.955283 -0.668252 -0.223783
H -1.766878 -1.702736 -1.137966
H -2.347441 -0.157139 -1.806005
H -4.542298 -2.043718 -2.021237
H -5.505387 -2.122097 -0.506226
H -4.029407 -3.123736 -0.703050
H -3.824187 1.322220 1.848258
H 0.681032 1.068579 1.344643
H 3.068250 1.402602 1.759357
H 1.920872 -1.551228 -1.222262
H 5.487811 0.818922 1.278856
H 5.987856 -0.948504 -0.460752


