%chk=000056326.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056326

0 1
 O    1.306900       2.576100      0.5946000    
 N   -1.565000      0.2533000      0.1693000    
 C  -0.7698000       1.469000     -4.4300001E-02
 C   0.5449000       1.377500      0.7627000    
 C  -0.5274000       1.616500      -1.547600    
 C    1.437900      0.2298000      0.3423000    
 C   -2.816800      0.3303000     -0.5790000    
 C   -1.826100      6.4099997E-02   1.593700    
 C    1.291800      -1.000300      0.9593000    
 C    2.380200      0.4357000     -0.6501000    
 C    2.114500      -2.058000      0.5720000    
 C    3.202800     -0.6222000      -1.037500    
 C    3.069800      -1.869000     -0.4264000    
 C   -3.599300     -0.8992000     -0.4186000    
 C   -4.244400      -1.903700     -0.2905000    
 H   -1.313100       2.363000      0.2935000    
 H   0.3837000       1.340200       1.843000    
 H   0.2648000       2.347400      -1.745600    
 H  -0.2335000      0.6761000      -2.027900    
 H   -1.407700       2.009900      -2.067900    
 H   -3.417200       1.196400     -0.2724000    
 H   -2.649300      0.4138000      -1.657100    
 H   -2.464600      0.8646000       1.989800    
 H  -0.9628000      6.6999998E-03   2.252000    
 H   -2.342100     -0.8854000       1.777100    
 H   0.5903000      -1.181800       1.761500    
 H    2.503000       1.391100      -1.150700    
 H   0.7467000       3.320800      0.8727000    
 H    2.017000      -3.027000       1.053100    
 H    3.945800     -0.4759000      -1.816100    
 H    3.711300      -2.692300     -0.7270000    
 H   -4.816200      -2.794800     -0.1763000    


%chk=000056326-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056326

0 1
O 1.371084 2.569214 0.736006
N -1.714982 0.435100 0.459980
C -0.748573 1.485277 0.016511
C 0.609755 1.307672 0.799479
C -0.489916 1.538067 -1.499338
C 1.503136 0.199952 0.254665
C -2.700124 -0.030563 -0.550273
C -2.366593 0.776888 1.742439
C 1.090696 -1.154002 0.361040
C 2.743755 0.497901 -0.360377
C 1.903970 -2.190222 -0.149946
C 3.558053 -0.541435 -0.866003
C 3.141839 -1.888772 -0.765333
C -3.402287 -1.261765 -0.132295
C -4.018551 -2.281518 0.183719
H -1.145509 2.492875 0.319431
H 0.362777 1.079633 1.857919
H 0.315930 2.269429 -1.686007
H -0.147933 0.564614 -1.890734
H -1.381823 1.864445 -2.062799
H -3.475758 0.746131 -0.778956
H -2.169437 -0.241343 -1.493439
H -3.061894 1.649488 1.653559
H -1.607209 1.024159 2.503747
H -2.943019 -0.088517 2.110095
H 0.124672 -1.382153 0.823770
H 3.063469 1.541453 -0.422555
H 0.820568 3.290410 1.132559
H 1.573000 -3.231623 -0.063444
H 4.518756 -0.298453 -1.334957
H 3.775322 -2.693737 -1.155605
H -4.547075 -3.175906 0.458742


