%chk=000116369.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116369

0 1
 N    8.881300     -0.5650000       1.240500    
 N    8.907900     -0.4208000      -1.115500    
 C   -1.713700     -0.3721000     -0.1167000    
 C  -0.4691000      0.5152000     -6.0600001E-02
 C   -2.995200      0.4617000     -5.0900001E-02
 C   0.8117000     -0.3203000     -9.3500003E-02
 C   -4.237900     -0.4305000     -7.3700003E-02
 C    2.055900      0.5649000     -3.8000001E-03
 C   -5.550900      0.3529000      1.4100000E-02
 C    3.337800     -0.2684000     -7.0400000E-02
 C   -6.831400     -0.4877000     -2.5200000E-02
 C    4.580400      0.6161000      5.3399999E-02
 C   -8.142700      0.2905000      0.1184000    
 C    5.893100     -0.1656000     -3.7999999E-02
 C   -9.387400     -0.5881000     -8.8000000E-03
 C    7.134100      0.7196000      5.9000000E-02
 C   -10.66100      0.2312000      0.1338000    
 C    8.387200     -0.1335000      3.7799999E-02
 H   -1.704600     -0.9616000      -1.041500    
 H   -1.695200      -1.081800      0.7195000    
 H  -0.4760000       1.213300     -0.9066000    
 H  -0.4896000       1.117500      0.8559000    
 H   -2.996200       1.064600      0.8653000    
 H   -3.027300       1.158300     -0.8972000    
 H   0.8088000      -1.032900      0.7402000    
 H   0.8423000     -0.9067000      -1.020000    
 H   -4.192200      -1.140100      0.7617000    
 H   -4.239500      -1.026100     -0.9949000    
 H    2.049800       1.293400     -0.8237000    
 H    2.034000       1.133100      0.9341000    
 H   -5.585700       1.078300     -0.8086000    
 H   -5.547500      0.9388000      0.9420000    
 H    3.338400      -1.012600      0.7351000    
 H    3.371000     -0.8176000      -1.019000    
 H   -6.851000      -1.042700     -0.9717000    
 H   -6.782000      -1.240000      0.7723000    
 H    4.562800       1.375700     -0.7381000    
 H    4.549000       1.153700       1.009200    
 H   -8.150800      0.7988000       1.090500    
 H   -8.175200       1.074600     -0.6483000    
 H    5.918300     -0.7218000     -0.9838000    
 H    5.917400     -0.9192000      0.7596000    
 H   -9.370600      -1.368400      0.7608000    
 H   -9.388900      -1.091500     -0.9824000    
 H    7.113800       1.298700      0.9896000    
 H    7.160200       1.435100     -0.7706000    
 H   -10.72160       1.000800     -0.6423000    
 H   -10.70360      0.7234000       1.110700    
 H   -11.53940     -0.4151000      4.0500000E-02
 H    9.712100      -1.145000       1.285900    
 H    8.434900     -0.3276000       2.120100    
 H    8.365100     -6.9999998E-04  -1.877000    


%chk=000116369-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116369

0 1
N 8.955629 -0.748505 1.033502
N 9.283011 -0.165301 -1.198562
C -1.755108 -0.386499 0.006053
C -0.486306 0.494987 0.041660
C -3.067763 0.428730 0.031866
C 0.827213 -0.318633 0.010512
C -4.337560 -0.451366 -0.003399
C 2.094569 0.564808 0.048600
C -5.649563 0.364995 0.021176
C 3.408937 -0.247007 0.005232
C -6.920000 -0.514353 -0.015022
C 4.674382 0.638880 0.051329
C -8.231871 0.302235 0.011254
C 5.987058 -0.173068 -0.017465
C -9.502485 -0.577579 -0.028027
C 7.249391 0.729975 0.047325
C -10.807995 0.246617 0.001379
C 8.554416 -0.058742 -0.105403
H -1.735573 -1.020038 -0.905533
H -1.740609 -1.084773 0.869142
H -0.503206 1.195335 -0.819696
H -0.504690 1.126384 0.954826
H -3.087046 1.062981 0.943032
H -3.082098 1.126500 -0.831649
H 0.843673 -1.020875 0.870306
H 0.846431 -0.947772 -0.904056
H -4.324050 -1.148772 0.860432
H -4.318254 -1.085976 -0.914278
H 2.073131 1.272087 -0.806901
H 2.078494 1.188468 0.967110
H -5.662726 1.062775 -0.842354
H -5.669088 0.999354 0.932260
H 3.427711 -0.959134 0.856734
H 3.427290 -0.865121 -0.916561
H -6.901261 -1.147670 -0.926878
H -6.906517 -1.213093 0.847790
H 4.646204 1.360984 -0.791469
H 4.662285 1.245918 0.981214
H -8.253186 0.934049 0.924107
H -8.246136 1.002394 -0.850394
H 6.009955 -0.762433 -0.955518
H 6.009624 -0.906875 0.813130
H -9.486376 -1.278369 0.831710
H -9.480855 -1.206756 -0.941422
H 7.248286 1.288120 1.005885
H 7.197858 1.483221 -0.760926
H -10.860172 0.935979 -0.862623
H -10.869020 0.858571 0.921292
H -11.701000 -0.404572 -0.031293
H 9.797847 -1.318106 0.979399
H 8.445076 -0.683193 1.908261
H 8.883146 0.387035 -1.979890


