%chk=000085899.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085899

0 1
 N   -1.600700       1.300500     -0.5497000    
 N    1.244400      0.9441000     -0.2014000    
 C  -0.8687000       1.995200      0.5104000    
 C   0.3504000       1.158000      0.9049000    
 C  -0.4760000       3.384800      1.0300000E-02
 C   -2.452900      0.2495000     -0.3069000    
 C    2.392800      0.1663000     -0.1300000    
 C   -3.142700     -0.3936000      -1.359300    
 C   -2.672300     -0.2283000       1.004800    
 C    2.754300     -0.4746000       1.068000    
 C    3.220900      2.4000001E-03  -1.254200    
 C   -4.007900      -1.459500      -1.112600    
 C   -3.537500      -1.294400       1.251300    
 C    3.908100      -1.255100       1.139600    
 C    4.374700     -0.7783000      -1.182500    
 C   -4.205200      -1.909900      0.1926000    
 C    4.718200      -1.407000      1.4400000E-02
 H   -1.507300       2.160900       1.386000    
 H   0.8816000       1.680500       1.710700    
 H   2.6900001E-02  0.1919000       1.306000    
 H   -1.416500       1.556400      -1.513400    
 H   0.1130000       3.347800     -0.9120000    
 H   -1.371600       3.978400     -0.2063000    
 H   0.1066000       3.920700      0.7669000    
 H    1.003600       1.327600      -1.108500    
 H   -3.001600     -5.6400001E-02  -2.384200    
 H   -2.190400      0.2123000       1.872100    
 H    2.155500     -0.3813000       1.969800    
 H    2.967700      0.4859000      -2.195000    
 H   -4.528100      -1.938900      -1.936700    
 H   -3.693200      -1.644700       2.267600    
 H    4.176700      -1.744200       2.071500    
 H    5.005800     -0.8967000      -2.058400    
 H   -4.879300      -2.739700      0.3847000    
 H    5.616700      -2.014600      7.0299998E-02


%chk=000085899-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085899

0 1
N -1.593323 1.238983 -0.507068
N 1.176037 0.605128 -0.131247
C -0.826615 1.873034 0.584403
C 0.381363 0.993145 1.029813
C -0.357619 3.266478 0.116385
C -2.563881 0.234766 -0.328728
C 2.453487 0.038402 -0.055494
C -3.365537 -0.159065 -1.441946
C -2.776013 -0.412488 0.922784
C 3.175302 -0.057136 1.171825
C 3.075617 -0.448616 -1.245981
C -4.342839 -1.162871 -1.305124
C -3.760472 -1.417415 1.045038
C 4.475595 -0.607102 1.192931
C 4.369449 -1.000427 -1.207429
C -4.551252 -1.804611 -0.059785
C 5.087569 -1.083179 0.011542
H -1.483799 1.999138 1.472053
H 0.997036 1.591886 1.728380
H 0.019006 0.104265 1.594314
H -1.667152 1.781340 -1.369634
H 0.342709 3.177103 -0.734071
H -1.216695 3.893175 -0.185389
H 0.173141 3.787886 0.931084
H 0.618171 0.409615 -0.967300
H -3.214750 0.328509 -2.414288
H -2.180630 -0.138925 1.798859
H 2.722666 0.285255 2.107889
H 2.534058 -0.386092 -2.198865
H -4.945631 -1.446345 -2.175788
H -3.906738 -1.901873 2.017643
H 5.010760 -0.669373 2.148145
H 4.822679 -1.368033 -2.135747
H -5.310290 -2.586566 0.043918
H 6.094591 -1.511993 0.037676


