%chk=000064092.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064092

0 1
 O  -0.2978000      -2.230900     -0.2079000    
 N   -1.068600     -4.3900002E-02 -0.4489000    
 N   -3.351100      0.3655000      0.1609000    
 N   0.4317000       1.795900     -0.3147000    
 C   -2.447900     -0.4652000     -0.6390000    
 C    1.281200     -0.4963000     -6.0100000E-02
 C  -9.1399997E-02  -1.021600     -0.2440000    
 C    1.484300      0.8896000     -0.1030000    
 C  -0.7521000       1.302200     -0.4719000    
 C   -3.066600      0.2467000       1.593800    
 C   -4.741800     -1.3600000E-02 -9.9500000E-02
 C    2.351200      -1.371500      0.1528000    
 C    2.780700       1.386500      7.1900003E-02
 C    3.636600     -0.8599000      0.3248000    
 C    3.851500      0.5165000      0.2848000    
 H   -2.571200      -1.530800     -0.4127000    
 H   -2.663700     -0.3193000      -1.704700    
 H   -1.598200       1.979200     -0.6627000    
 H   -2.069900      0.6191000       1.850900    
 H   -3.147100     -0.7892000       1.943400    
 H   -3.770700      0.8559000       2.172700    
 H   -4.948600      -1.052600      0.1822000    
 H   -4.981500      0.1103000      -1.161500    
 H   -5.428400      0.6374000      0.4531000    
 H    2.203900      -2.447200      0.1876000    
 H    2.964900       2.457800      4.3400001E-02
 H    4.471500      -1.534600      0.4906000    
 H    4.853700      0.9134000      0.4193000    


%chk=000064092-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064092

0 1
O -0.318565 -2.287317 0.017563
N -1.042358 -0.089379 -0.422743
N -3.347362 0.249201 0.289099
N 0.459032 1.803326 -0.491490
C -2.457751 -0.535225 -0.578541
C 1.325262 -0.484961 -0.017134
C -0.030979 -1.060325 -0.126650
C 1.526744 0.922322 -0.208537
C -0.744191 1.266567 -0.577862
C -3.216022 -0.092507 1.721697
C -4.747486 0.271623 -0.178654
C 2.428865 -1.329190 0.273801
C 2.841008 1.456039 -0.107016
C 3.720943 -0.787109 0.371476
C 3.924531 0.609392 0.179516
H -2.445310 -1.626315 -0.366839
H -2.769159 -0.380632 -1.628108
H -1.613423 1.905885 -0.758349
H -2.156483 -0.033781 2.024110
H -3.589012 -1.117388 1.960188
H -3.783414 0.636377 2.326080
H -5.257137 -0.720979 -0.117730
H -4.789077 0.616846 -1.227444
H -5.323820 0.984396 0.437073
H 2.239945 -2.398554 0.414186
H 2.971047 2.532008 -0.256732
H 4.573847 -1.436919 0.594157
H 4.934923 1.026000 0.256479


