%chk=000025399.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025399

0 1
 N  -0.7487000      -1.279200     -1.2000001E-03
 C  -8.2199998E-02   1.019500     -6.0000003E-04
 C   0.2358000     -0.3509000     -8.9999998E-04
 C    1.598000     -0.7247000     -6.0000003E-04
 C   -1.430700       1.392800     -1.9999999E-04
 C    2.616300      0.2634000     -9.9999997E-05
 C    2.265400       1.614700     -9.9999997E-05
 C   -2.438900      0.4263000       0.000000    
 C   0.9274000       1.989900     -5.0000002E-04
 C   -2.046500     -0.9193000     -6.9999998E-04
 C    1.998600      -2.078200     -3.9999999E-04
 C   -1.806200       2.849400     -9.9999997E-05
 C    3.968500     -0.1177000      6.9999998E-04
 C    3.286100       2.710400      3.9999999E-04
 C   -3.801600      0.7727000      8.9999998E-04
 C   -3.042500      -1.892300     -5.0000002E-04
 C    3.346800      -2.442400      5.0000002E-04
 C    4.330900      -1.462700      1.2000001E-03
 C   -4.778800     -0.2180000      1.4000000E-03
 C   -4.397900      -1.553700      6.0000003E-04
 H   0.7076000       3.052000     -2.8700000E-02
 H    1.259100      -2.877100     -7.9999998E-04
 H   -2.779800       3.065900      0.4428000    
 H   -1.140500       3.446400      0.6311000    
 H   -1.788800       3.244600      -1.020700    
 H    4.774000      0.6121000      1.1000000E-03
 H    2.826400       3.705200      3.3000000E-03
 H    3.915200       2.650500      0.8949000    
 H    3.912600       2.653600     -0.8961000    
 H   -4.165300       1.793100     -2.7500000E-02
 H   -2.768700      -2.945900     -1.5000000E-03
 H    3.624400      -3.492500      6.9999998E-04
 H    5.379800      -1.744000      1.8000000E-03
 H   -5.830900      5.0200000E-02 -4.4000000E-03
 H   -5.151900      -2.335400     -7.9999998E-04


%chk=000025399-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000025399

0 1
N -0.737676 -1.293608 0.003563
C -0.119529 1.098269 -0.000390
C 0.208262 -0.317637 -0.000394
C 1.619142 -0.724616 -0.004798
C -1.488558 1.495536 0.004002
C 2.656744 0.270937 -0.008891
C 2.300813 1.690278 -0.009100
C -2.494709 0.472212 0.008477
C 0.965941 2.057565 -0.004951
C -2.060079 -0.921065 0.007900
C 1.968501 -2.104806 -0.004941
C -1.839533 2.972286 0.004120
C 4.018352 -0.161168 -0.012598
C 3.386394 2.749043 -0.013643
C -3.911591 0.730391 0.013517
C -3.040381 -1.970892 0.012050
C 3.313073 -2.504948 -0.008827
C 4.344969 -1.525923 -0.012573
C -4.838319 -0.311015 0.017527
C -4.401522 -1.677072 0.016747
H 0.720564 3.124682 -0.005196
H 1.152789 -2.833132 -0.001876
H -2.923736 3.151339 0.003309
H -1.421246 3.478766 0.894150
H -1.420158 3.479180 -0.885126
H 4.820961 0.582923 -0.015440
H 2.949163 3.761265 -0.017114
H 4.040125 2.666936 0.875899
H 4.039339 2.660422 -0.903042
H -4.278918 1.761094 0.014388
H -2.667817 -2.999852 0.011398
H 3.569639 -3.569987 -0.008963
H 5.395380 -1.838141 -0.015431
H -5.910785 -0.086660 0.021333
H -5.142594 -2.483903 0.019915


