%chk=000135603.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135603

1 1
 N  -0.1792000      0.8217000      0.2667000    
 N    3.931300      -3.565300     -0.4482000    
 N   -4.946100      0.7090000      0.6831000    
 N   -5.471300       1.030300     -0.4053000    
 N   -5.955900       1.326400      -1.395400    
 C    1.031900      0.2808000      0.1155000    
 C   -1.312300      0.1014000      0.3109000    
 C    1.188200      -1.093800     -7.4999998E-03
 C   -1.245300      -1.307400      0.1930000    
 C   4.1299999E-02  -1.919900      2.9500000E-02
 C  -0.2632000       2.295500      0.3916000    
 C    2.134300       1.225300      9.1700003E-02
 C    2.469700      -1.646400     -0.1658000    
 C   -2.537600      0.7655000      0.4731000    
 C   0.2533000      -3.314500     -9.9799998E-02
 C   -2.476400      -2.005100      0.2477000    
 C    2.640200      -3.021900     -0.2900000    
 C  -0.4190000       2.910500     -0.9849000    
 C   -3.725900      4.5299999E-02  0.5220000    
 C    1.532000      -3.856300     -0.2571000    
 C   -3.695700      -1.338900      0.4094000    
 C    2.552600       1.770900      -1.119300    
 C    2.767400       1.581400       1.279800    
 C    3.611400       2.678600      -1.142500    
 C    3.826200       2.489200       1.256500    
 C    4.248100       3.037800      4.5299999E-02
 H   -1.042600       2.602400       1.091700    
 H   0.6056000       2.718300      0.8950000    
 H    3.360400      -1.022500     -0.1960000    
 H   -2.654200       1.840200      0.5318000    
 H  -0.5803000      -4.012100     -8.0499999E-02
 H   -2.511100      -3.088400      0.1650000    
 H   9.7900003E-02   2.375100      -1.781200    
 H  -7.7900000E-02   3.950600     -0.9778000    
 H   -1.476000       2.925500      -1.272600    
 H    1.643600      -4.933400     -0.3524000    
 H   -4.615800      -1.916800      0.4466000    
 H    2.093300       1.478400      -2.059900    
 H    2.450500       1.161800       2.231500    
 H    3.945200       3.099700      -2.086300    
 H    4.322400       2.768600       2.181200    
 H    4.738300      -2.956200     -0.4715000    
 H    4.052100      -4.565400     -0.5374000    
 H    5.073800       3.743100      2.7100001E-02


%chk=000135603-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135603

1 1
N -0.161050 1.005385 0.144325
N 3.889607 -3.607835 -0.258244
N -5.015697 0.877806 0.260536
N -6.147834 0.296639 0.259214
N -7.284897 -0.026486 0.271973
C 1.073292 0.418116 0.074956
C -1.365649 0.243767 0.123133
C 1.205136 -1.013814 -0.018345
C -1.280477 -1.191958 0.037386
C 0.013603 -1.833175 -0.037150
C -0.265911 2.508657 0.227298
C 2.298919 1.280508 0.102852
C 2.499361 -1.605928 -0.093887
C -2.626637 0.887710 0.194146
C 0.190337 -3.247668 -0.131088
C -2.508844 -1.925951 0.032317
C 2.648341 -3.007687 -0.185037
C -0.585487 3.158828 -1.132089
C -3.810847 0.129087 0.186500
C 1.457475 -3.819233 -0.202064
C -3.748745 -1.298367 0.105123
C 2.841204 1.794892 -1.103445
C 2.957120 1.533397 1.335501
C 4.018998 2.574728 -1.071964
C 4.131439 2.318078 1.360370
C 4.662531 2.842208 0.158548
H -1.028864 2.746730 0.985699
H 0.695418 2.881346 0.606650
H 3.383922 -0.963114 -0.082901
H -2.733507 1.970849 0.249221
H -0.676580 -3.912638 -0.149955
H -2.483131 -3.016415 -0.027760
H 0.237064 2.999450 -1.849070
H -0.701471 4.247184 -0.989150
H -1.516605 2.772731 -1.578650
H 1.556155 -4.908657 -0.273732
H -4.668351 -1.893128 0.100278
H 2.357796 1.573692 -2.061784
H 2.554082 1.120662 2.267279
H 4.432970 2.968459 -2.005786
H 4.630668 2.515839 2.314317
H 4.744430 -3.056306 -0.248021
H 3.982703 -4.618722 -0.323693
H 5.573213 3.449335 0.180493


