%chk=000056642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056642

0 1
 O    1.010000       2.398800     -0.1687000    
 N   -2.610500      0.2305000      0.2171000    
 C  -0.1850000      0.2980000     -0.2178000    
 C   1.6799999E-02  -1.034300      0.5274000    
 C   -1.411300       1.066000      0.2756000    
 C    1.234000      -1.766100     -5.5500001E-02
 C   -2.878000     -0.1887000      -1.165800    
 C   -3.761900      0.9434000      0.7882000    
 C    1.065200       1.172200     -0.1599000    
 C   -4.101200      -1.104100      -1.238300    
 C   -5.014000      6.5200001E-02  0.7795000    
 C   -5.328000     -0.4394000     -0.6243000    
 C    2.466700     -0.9042000     -0.1000000    
 C    2.388100      0.4946000     -0.1599000    
 C   0.1300000     -0.8853000       2.051000    
 C    3.729500      -1.514400     -0.1255000    
 C    3.555300       1.266900     -0.2148000    
 C    4.890900     -0.7441000     -0.1834000    
 C    4.803500      0.6449000     -0.2249000    
 H  -0.2823000      9.4999999E-02  -1.292400    
 H  -0.8433000      -1.691400      0.3448000    
 H   -1.548400       1.974700     -0.3273000    
 H   -1.239200       1.412600       1.302700    
 H    1.009900      -2.085100      -1.081700    
 H    1.429400      -2.674400      0.5281000    
 H   -2.059000     -0.7765000      -1.588500    
 H   -3.029900      0.6818000      -1.817600    
 H   -3.960100       1.871700      0.2364000    
 H   -3.548600       1.221100       1.827700    
 H   -3.890600      -2.042300     -0.7091000    
 H   -4.307800      -1.365400      -2.282400    
 H   -5.867200      0.6330000       1.167600    
 H   -4.867000     -0.7904000       1.450900    
 H   -5.642200      0.4020000      -1.254000    
 H   -6.163200      -1.147500     -0.5918000    
 H   0.9209000     -0.1878000       2.343000    
 H  -0.8090000     -0.5309000       2.486900    
 H   0.3505000      -1.852500       2.516100    
 H    3.815200      -2.598100     -9.7300000E-02
 H    3.514000       2.352000     -0.2548000    
 H    5.863000      -1.228100     -0.1973000    
 H    5.708000       1.244600     -0.2698000    


%chk=000056642-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056642

0 1
O 1.027575 2.435545 -0.096430
N -2.638535 0.236020 0.085744
C -0.134503 0.282428 -0.262809
C 0.048191 -1.054740 0.518908
C -1.410847 1.070864 0.111896
C 1.276209 -1.797289 -0.065665
C -3.032063 -0.157525 -1.292118
C -3.760598 0.913513 0.789299
C 1.112314 1.171013 -0.152121
C -4.255815 -1.096682 -1.281184
C -5.004526 0.006758 0.868993
C -5.445055 -0.441712 -0.543064
C 2.534858 -0.941227 -0.082028
C 2.442909 0.481713 -0.134857
C 0.157499 -0.854381 2.047767
C 3.819860 -1.535212 -0.054327
C 3.622202 1.273740 -0.165626
C 4.988923 -0.744604 -0.092212
C 4.891680 0.668470 -0.149508
H -0.189744 0.001992 -1.341099
H -0.859095 -1.658959 0.328806
H -1.492001 1.958871 -0.560099
H -1.292041 1.472815 1.135067
H 1.041578 -2.104466 -1.108313
H 1.466627 -2.731298 0.496788
H -2.179035 -0.669043 -1.775591
H -3.265577 0.749342 -1.912595
H -4.038759 1.870558 0.271968
H -3.417599 1.180301 1.806762
H -3.977636 -2.038530 -0.769253
H -4.532830 -1.349793 -2.322870
H -5.822562 0.550412 1.379888
H -4.759333 -0.883195 1.480749
H -5.792442 0.441780 -1.117850
H -6.298361 -1.143312 -0.480578
H 1.012764 -0.211445 2.326587
H -0.764179 -0.397432 2.447332
H 0.290926 -1.828932 2.553142
H 3.903470 -2.627614 -0.000087
H 3.506749 2.362259 -0.200656
H 5.973687 -1.225401 -0.071139
H 5.798312 1.282396 -0.177415


