%chk=000017929.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017929

0 1
 N    2.030800      -1.593800     -0.7081000    
 N  -0.3517000      -1.891900       1.047200    
 N    1.417900       3.794100      0.8529000    
 C    1.870100     -0.2638000     -0.3304000    
 C    1.815900      -2.683500      0.2531000    
 C   0.6869000      0.1986000      0.2866000    
 C   0.9755000      -2.322600       1.469000    
 C  -0.4662000     -0.7225000      0.5098000    
 C    2.874600      0.6961000     -0.5658000    
 C   0.5416000       1.537000      0.6882000    
 C    2.869300      -1.912700      -1.858900    
 C   -1.826900     -0.2891000      8.0200002E-02
 C    1.563500       2.450100      0.4543000    
 C    2.726800       2.031800     -0.1784000    
 C   -1.965100      0.5678000      -1.005900    
 C   -2.944500     -0.7464000      0.7692000    
 C   -3.237700      0.9732000      -1.408000    
 C   -4.217100     -0.3411000      0.3668000    
 C   -4.363700      0.5187000     -0.7218000    
 H    2.792700      -3.038900      0.6042000    
 H    1.342200      -3.521000     -0.2744000    
 H   0.8586000      -3.215300       2.094500    
 H    1.465300      -1.577000       2.108100    
 H    3.812100      0.4143000      -1.040500    
 H  -0.3663000       1.867600       1.188300    
 H    3.931500      -1.870100      -1.595100    
 H    2.675700      -1.231700      -2.695300    
 H    2.655900      -2.925700      -2.218100    
 H    3.535600       2.731800     -0.3730000    
 H   -1.112400      0.9181000      -1.580100    
 H   -2.854300      -1.409600       1.625000    
 H   -3.352600       1.637500      -2.259600    
 H   -5.094000     -0.6936000      0.9020000    
 H   0.5725000       4.095600       1.318900    
 H    2.165200       4.455200      0.6876000    
 H   -5.354600      0.8333000      -1.035700    


%chk=000017929-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017929

0 1
N 2.055793 -1.633187 -0.730948
N -0.397312 -1.912576 0.991233
N 1.447427 3.854317 0.738256
C 1.904493 -0.282389 -0.312152
C 1.812050 -2.763081 0.203442
C 0.668281 0.206957 0.245270
C 0.949235 -2.359046 1.409424
C -0.499643 -0.705356 0.468728
C 2.942326 0.668729 -0.535027
C 0.547338 1.575550 0.593713
C 3.066086 -1.949705 -1.747150
C -1.877484 -0.244864 0.093733
C 1.596284 2.507091 0.384156
C 2.798053 2.028516 -0.207219
C -2.091793 0.717546 -0.929673
C -3.006322 -0.815040 0.743301
C -3.402288 1.102191 -1.290807
C -4.313203 -0.426050 0.387052
C -4.517775 0.536366 -0.631852
H 2.784248 -3.163555 0.584329
H 1.311656 -3.581084 -0.351815
H 0.833975 -3.244540 2.059379
H 1.486751 -1.573555 1.984912
H 3.893714 0.333321 -0.960183
H -0.397653 1.920898 1.030112
H 4.105515 -2.007001 -1.343124
H 3.046317 -1.199766 -2.555705
H 2.829367 -2.935111 -2.189523
H 3.627835 2.721533 -0.395284
H -1.232480 1.149860 -1.452572
H -2.826584 -1.568471 1.516410
H -3.552577 1.837766 -2.089271
H -5.173625 -0.869781 0.900919
H 0.584921 4.189648 1.155457
H 2.204356 4.515835 0.598632
H -5.534183 0.838536 -0.909354


