%chk=000117689.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117689

0 1
 N   0.2869000      0.8687000      4.5200001E-02
 N   -5.413400      -1.697100     -0.1991000    
 N  -0.5294000       2.971100     -0.6563000    
 N    1.354500       2.943100      0.6822000    
 C   -1.984500     -1.7700000E-02  0.2673000    
 C  -0.7733000      0.1719000     -0.6436000    
 C   -3.133000     -0.7583000     -0.4296000    
 C    1.251000      3.5100002E-02  0.7770000    
 C   -4.329400      -1.008700      0.4909000    
 C   0.4189000       2.274200      5.7500001E-02
 C    2.396200     -0.2880000     -0.1319000    
 C    3.179000      -1.383800     -0.1141000    
 C    4.317100      -1.648300      -1.058700    
 C    2.959400      -2.462200      0.9135000    
 H   -2.345500      0.9581000      0.6154000    
 H   -1.689000     -0.5756000       1.164600    
 H  -0.4182000     -0.8187000     -0.9591000    
 H   -1.054500      0.6636000      -1.581200    
 H   -3.456100     -0.1745000      -1.301000    
 H   -2.762900      -1.718900     -0.8104000    
 H    1.620400      0.5665000       1.661200    
 H   0.7459000     -0.8671000       1.136200    
 H   -4.015400      -1.613700       1.348400    
 H   -4.702200     -5.5000000E-02  0.8811000    
 H    2.632000      0.4647000     -0.8842000    
 H   -5.733100      -1.132000     -0.9846000    
 H   -6.209900      -1.790100      0.4298000    
 H    4.148200      -2.581000      -1.606600    
 H    4.426600     -0.8440000      -1.793600    
 H    5.260200      -1.729900     -0.5091000    
 H    3.917500      -2.754100       1.358400    
 H    2.317200      -2.164800       1.745700    
 H    2.521300      -3.347000      0.4400000    
 H   -1.354100       2.543000      -1.057500    
 H  -0.4918000       3.983900     -0.7075000    
 H    1.207500       3.945100      0.5196000    


%chk=000117689-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117689

0 1
N 0.383783 1.206584 0.220064
N -4.944476 -2.217772 -0.247373
N -0.613318 3.204333 -0.558605
N 1.670119 3.180246 0.282269
C -1.874619 0.057948 0.362392
C -0.610184 0.371310 -0.478157
C -2.815993 -0.940307 -0.346715
C 1.459838 0.500413 0.962193
C -4.090806 -1.246247 0.465718
C 0.525692 2.579545 -0.007527
C 2.497298 -0.107020 0.037296
C 2.797642 -1.427688 -0.133275
C 3.886106 -1.855783 -1.106136
C 2.130675 -2.575616 0.608312
H -2.423008 0.996907 0.589040
H -1.560907 -0.355373 1.342058
H -0.115322 -0.582356 -0.750605
H -0.898184 0.855890 -1.430603
H -3.104870 -0.535789 -1.341119
H -2.289661 -1.895611 -0.537147
H 1.946241 1.260594 1.598358
H 0.990593 -0.259903 1.614089
H -3.798182 -1.696300 1.434290
H -4.602659 -0.279872 0.704520
H 3.047864 0.642498 -0.548703
H -5.266157 -1.891199 -1.164471
H -5.711825 -2.602946 0.311301
H 3.480452 -2.529931 -1.887444
H 4.350450 -0.988416 -1.605829
H 4.685087 -2.421154 -0.585412
H 2.858171 -3.088965 1.268643
H 1.280349 -2.255768 1.233109
H 1.762731 -3.338490 -0.106247
H -1.546652 2.817017 -0.438015
H -0.531582 4.164764 -0.879171
H 1.609414 4.212957 0.224801


