%chk=000020601.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020601

0 1
 O    4.513000      0.5275000     -0.2212000    
 N    2.452300     -0.4359000     -0.1780000    
 N    1.428500       2.123100      0.3009000    
 N    2.749600       1.873900      0.2315000    
 C    1.176500     -0.2662000     -4.8700001E-02
 C   0.6246000       1.124400      0.1238000    
 C   0.3067000      -1.457700     -3.3399999E-02
 C  -0.8246000       1.396200      5.8400001E-02
 C  -0.2498000      -1.930200      -1.222000    
 C   4.1200001E-02  -2.112200       1.169500    
 C   -1.593900       1.341300       1.218500    
 C   -1.417800       1.707300      -1.163200    
 C   -1.072100      -3.056900      -1.207600    
 C  -0.7810000      -3.238900       1.183700    
 C   -2.963400       1.598400       1.156900    
 C   -2.787300       1.964600      -1.224800    
 C   -1.337600      -3.711200     -4.9000001E-03
 C   -3.560100       1.910000     -6.4700000E-02
 C    3.295100      0.6425000     -7.4800000E-02
 H  -4.9400002E-02  -1.427900      -2.164800    
 H   0.4690000      -1.751800       2.101400    
 H   -1.138500       1.099300       2.175200    
 H  -0.8245000       1.751100      -2.072600    
 H   -1.505700      -3.424500      -2.133100    
 H  -0.9882000      -3.748200       2.120300    
 H   -3.565200       1.555600       2.060000    
 H   -3.252200       2.206700      -2.176000    
 H   -1.978000      -4.588300      6.3000000E-03
 H   -4.626500       2.110000     -0.1128000    
 H    3.344500       2.687400      0.3508000    


%chk=000020601-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000020601

0 1
O 4.447994 0.680850 0.882508
N 2.365793 -0.418526 0.581824
N 1.415987 2.013600 -0.514080
N 2.737385 1.759462 -0.291013
C 1.071535 -0.271463 0.253583
C 0.543606 1.038177 -0.179804
C 0.254950 -1.517950 0.265622
C -0.892994 1.417780 -0.251726
C -0.801503 -1.739038 -0.660566
C 0.606377 -2.552513 1.175797
C -1.818564 0.963237 0.726525
C -1.342467 2.307366 -1.264481
C -1.496489 -2.966324 -0.664473
C -0.102949 -3.769911 1.181211
C -3.166019 1.378603 0.680579
C -2.691155 2.716674 -1.310359
C -1.158089 -3.980984 0.261322
C -3.609813 2.252011 -0.339406
C 3.266883 0.652653 0.455093
H -1.068750 -0.966734 -1.387710
H 1.444956 -2.382396 1.857949
H -1.485639 0.295097 1.527238
H -0.624668 2.672472 -2.005961
H -2.299920 -3.131302 -1.390367
H 0.168802 -4.555219 1.894669
H -3.867390 1.024432 1.443775
H -3.025828 3.396623 -2.101426
H -1.707141 -4.929208 0.262058
H -4.657670 2.569712 -0.375271
H 3.377981 2.512216 -0.558507


