%chk=000012855.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012855

0 1
 N  -0.4881000       1.050500     -0.2230000    
 N  -0.4762000      -1.123700      0.2381000    
 C   -1.807700      0.6853000     -0.1463000    
 C   0.2677000     -6.3800000E-02  1.3800000E-02
 C   -1.773800     -0.6760000      0.1424000    
 C    1.709900     -2.4800001E-02  6.0999999E-03
 C   -2.991900       1.407000     -0.3001000    
 C   -2.983600      -1.375100      0.2900000    
 C    2.435500      -1.154600     -0.3718000    
 C    2.378600       1.141900      0.3769000    
 C   -4.186700      0.6953000     -0.1500000    
 C   -4.185000     -0.6709000      0.1399000    
 C    3.829800      -1.117900     -0.3785000    
 C    3.773000       1.178500      0.3701000    
 C    4.498600      4.8500001E-02 -7.7000000E-03
 H  -0.1492000       1.980200     -0.4327000    
 H   -2.990700       2.467500     -0.5250000    
 H   -2.992900      -2.436700      0.5152000    
 H    1.934300      -2.073300     -0.6672000    
 H    1.844200       2.035500      0.6893000    
 H   -5.134400       1.216500     -0.2612000    
 H   -5.129800      -1.196900      0.2509000    
 H    4.395000      -1.997300     -0.6731000    
 H    4.294300       2.085600      0.6617000    
 H    5.584300      7.6800004E-02 -1.2400000E-02


%chk=000012855-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000012855

0 1
N -0.531149 1.152986 0.019255
N -0.472348 -1.126609 -0.066626
C -1.870915 0.743934 0.001118
C 0.275365 -0.000846 -0.022347
C -1.811614 -0.693233 -0.053696
C 1.744273 0.030900 -0.017363
C -3.089737 1.451877 0.026600
C -3.008575 -1.446550 -0.084878
C 2.451268 -1.203003 -0.048909
C 2.482635 1.245899 0.017805
C -4.271263 0.679595 -0.005079
C -4.231336 -0.745717 -0.060041
C 3.859344 -1.218436 -0.044416
C 3.893529 1.226137 0.022383
C 4.588459 -0.004945 -0.008420
H -0.200088 2.114127 0.058667
H -3.131342 2.545398 0.068318
H -2.971384 -2.539202 -0.126511
H 1.869219 -2.129263 -0.076413
H 1.971871 2.216891 0.040164
H -5.242562 1.186177 0.012924
H -5.173974 -1.303231 -0.083151
H 4.391534 -2.175685 -0.069004
H 4.450151 2.169373 0.049609
H 5.683840 -0.018472 -0.004589


