%chk=000040029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040029

0 1
 N    4.556100      -2.063900     -0.6276000    
 C   -2.191700      0.8695000      -1.448300    
 C   -1.046100       1.855400      -1.367300    
 C   -2.446800       2.293000      -1.023500    
 C   -2.437400     -0.2487000     -0.4580000    
 C   1.2000000E-02   1.859300     -0.2847000    
 C   -1.402400      -1.002700      0.1364000    
 C   0.5563000      0.6831000      0.2752000    
 C   1.1900000E-02 -0.6399000     -0.1005000    
 C   -3.764000     -0.6098000     -0.1469000    
 C   0.5361000       3.090900      0.1574000    
 C   -1.703000      -2.063200       1.010600    
 C    1.574800      0.7578000       1.242800    
 C   0.8195000      -1.528600     -0.7062000    
 C   -4.057200      -1.664300      0.7193000    
 C    1.548200       3.159800       1.116000    
 C   -3.025300      -2.392300       1.297300    
 C    2.068600       1.991900       1.658000    
 C    2.265300      -1.274700     -0.9986000    
 C    3.153300      -2.314400     -0.3160000    
 C    4.971600     -0.7583000     -0.1355000    
 H   -2.497200      0.6244000      -2.465400    
 H  -0.6773000       2.190200      -2.336800    
 H   -2.957300       2.943800      -1.724200    
 H   -2.690200       2.490600      1.4400000E-02
 H   -4.588900     -5.9799999E-02 -0.5963000    
 H   0.1504000       4.019000     -0.2610000    
 H  -0.9072000      -2.633900       1.484700    
 H    1.974400     -0.1423000       1.704400    
 H   0.4301000      -2.496500      -1.017000    
 H   -5.090800      -1.916000      0.9378000    
 H    1.928700       4.125500       1.435200    
 H   -3.248100      -3.211800       1.973900    
 H    2.852100       2.040100       2.408200    
 H    2.575900     -0.2515000     -0.8011000    
 H    2.385000      -1.385000      -2.086300    
 H    3.000400      -2.314100      0.7702000    
 H    2.895000      -3.321000     -0.6661000    
 H    4.706500      -2.110200      -1.634800    
 H    4.655200     -0.5836000      0.8983000    
 H    4.631500      6.4099997E-02 -0.7713000    
 H    6.066300     -0.7186000     -0.1418000    


%chk=000040029-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000040029

0 1
N 4.683048 -2.265716 -0.525381
C -2.288844 0.932893 -1.425680
C -1.150468 1.955117 -1.337338
C -2.604724 2.403343 -1.087313
C -2.495028 -0.174951 -0.428410
C -0.131160 1.962614 -0.231173
C -1.406461 -0.950850 0.069696
C 0.479857 0.762275 0.237920
C 0.025626 -0.594914 -0.220060
C -3.820104 -0.531428 -0.071966
C 0.292630 3.209337 0.295299
C -1.685307 -2.074195 0.894645
C 1.498679 0.854957 1.225427
C 0.864461 -1.526865 -0.770626
C -4.085740 -1.645654 0.752141
C 1.309257 3.289102 1.270075
C -3.009740 -2.428103 1.230779
C 1.918507 2.101295 1.736219
C 2.330405 -1.370481 -1.100048
C 3.243605 -2.298053 -0.219839
C 5.384404 -0.993681 -0.279738
H -2.546984 0.633465 -2.450536
H -0.735330 2.256565 -2.308425
H -3.100419 3.018742 -1.844312
H -2.883495 2.626449 -0.052468
H -4.648404 0.073861 -0.460088
H -0.187768 4.124104 -0.072526
H -0.845677 -2.656082 1.291433
H 1.942787 -0.069607 1.610907
H 0.423968 -2.503196 -1.027464
H -5.117495 -1.901810 1.017936
H 1.618960 4.262661 1.666281
H -3.199195 -3.295987 1.872475
H 2.702282 2.144148 2.500850
H 2.649427 -0.319716 -0.983362
H 2.496043 -1.651593 -2.161776
H 3.113059 -2.017813 0.844357
H 2.892980 -3.343917 -0.318316
H 4.904068 -2.673355 -1.441620
H 5.237412 -0.698431 0.776334
H 5.056101 -0.135726 -0.913360
H 6.469078 -1.135507 -0.436047


