%chk=000031712.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031712

0 1
 N   -1.942300       1.234900      0.1609000    
 N   -1.916900      -1.120200     -1.6100001E-02
 C   -1.219700      2.6699999E-02  0.6094000    
 C   -2.765100      0.8184000     -0.9695000    
 C   -3.172700     -0.5798000     -0.5398000    
 C   0.2752000     -2.3800001E-02  0.3266000    
 C   -1.188900       2.450200     -7.4199997E-02
 C   -2.125600      -2.242300      0.8878000    
 C    1.174500      0.5087000       1.248000    
 C   0.7396000     -0.6026000     -0.8525000    
 C    2.544200      0.4623000      0.9890000    
 C    2.109500     -0.6492000      -1.111500    
 C    3.011800     -0.1167000     -0.1907000    
 C    4.476400     -0.1668000     -0.4673000    
 H   -1.357700     -1.6600000E-02   1.698900    
 H   -2.190400      0.7877000      -1.904000    
 H   -3.635600       1.467900      -1.104100    
 H   -3.952000     -0.5284000      0.2322000    
 H   -3.545100      -1.170800      -1.382100    
 H  -0.4724000       2.353400     -0.8969000    
 H  -0.6544000       2.760900      0.8294000    
 H   -1.869700       3.271700     -0.3247000    
 H   -1.166300      -2.632500       1.244600    
 H   -2.628500      -3.063000      0.3649000    
 H   -2.731000      -1.969100       1.759500    
 H   0.8229000      0.9620000       2.170900    
 H   6.5300003E-02  -1.009400      -1.600500    
 H    3.237200      0.8820000       1.713400    
 H    2.461400      -1.097500      -2.036900    
 H    4.735100      -1.044700      -1.069000    
 H    4.787600      0.7328000      -1.007500    
 H    5.052000     -0.2350000      0.4621000    


%chk=000031712-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031712

0 1
N -1.952279 1.262273 0.052451
N -2.006311 -1.078197 0.085833
C -1.258065 0.073185 0.658118
C -2.822375 0.789471 -1.046666
C -3.266743 -0.579120 -0.508083
C 0.245696 -0.034224 0.372772
C -1.176105 2.482851 -0.193416
C -2.099237 -2.261859 0.945853
C 1.188041 0.376546 1.345286
C 0.725469 -0.503079 -0.875493
C 2.574885 0.327627 1.078643
C 2.109642 -0.547863 -1.142835
C 3.059891 -0.126958 -0.174088
C 4.548631 -0.150256 -0.477281
H -1.384927 0.140514 1.768781
H -2.284785 0.670283 -2.019110
H -3.667951 1.485667 -1.197504
H -4.081298 -0.449173 0.245023
H -3.621279 -1.263387 -1.300514
H -0.417216 2.386136 -1.006047
H -0.645517 2.786724 0.726158
H -1.870999 3.298565 -0.465977
H -1.086646 -2.582720 1.248736
H -2.563125 -3.093703 0.385904
H -2.701638 -2.088943 1.872752
H 0.832914 0.727211 2.323744
H -0.003295 -0.864837 -1.609065
H 3.289604 0.639697 1.850579
H 2.464037 -0.921123 -2.112236
H 4.804575 -0.955433 -1.188650
H 4.877176 0.805027 -0.931885
H 5.147630 -0.299702 0.438516


