%chk=000050281.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050281

0 1
 N   -4.505400     -0.2380000      8.3600000E-02
 N    1.006300     -0.1210000     -0.6207000    
 N    1.583000     -8.7499999E-02  0.4916000    
 C   -3.517200       1.952600     -8.5000001E-02
 C   -4.754500       1.167700      0.3958000    
 C   -2.497200      0.8634000     -0.1716000    
 C   -3.134700     -0.3805000     -7.9300001E-02
 C   -1.129700      0.9780000     -0.3560000    
 C   -2.386700      -1.544500     -0.1674000    
 C   -5.381800      -1.295300      0.5197000    
 C  -0.3787000     -0.1938000     -0.4385000    
 C   -1.002700      -1.446400     -0.3447000    
 C    2.974600     -1.4500000E-02  0.3091000    
 C    3.594500       1.227600      0.2161000    
 C    3.721600      -1.185000      0.2229000    
 C    4.975700       1.300000      3.4899998E-02
 C    5.102900      -1.112700      4.1800000E-02
 C    5.729800      0.1299000     -5.2200001E-02
 H   -3.240400       2.737400      0.6245000    
 H   -3.689100       2.386300      -1.075700    
 H   -4.871600       1.288000       1.480800    
 H   -5.668900       1.532800     -8.4100001E-02
 H  -0.6609000       1.953600     -0.4357000    
 H   -2.851200      -2.523100     -0.1027000    
 H   -6.425000     -0.9635000      0.4902000    
 H   -5.149800      -1.595600       1.546800    
 H   -5.299100      -2.171200     -0.1318000    
 H  -0.4122000      -2.357200     -0.4135000    
 H    3.014500       2.144100      0.2837000    
 H    3.241300      -2.157000      0.2958000    
 H    5.463900       2.267400     -3.8199998E-02
 H    5.690200      -2.023800     -2.5900001E-02
 H    6.805200      0.1862000     -0.1932000    


%chk=000050281-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050281

0 1
N -4.586739 -0.239738 0.299020
N 0.972257 0.222270 -0.294151
N 1.795442 -0.385753 0.534777
C -3.851506 1.069834 -1.580797
C -5.082721 0.780713 -0.666341
C -2.677980 0.543533 -0.758961
C -3.194135 -0.237022 0.323588
C -1.303791 0.674299 -0.938078
C -2.318119 -0.887763 1.235775
C -5.438943 -0.729639 1.376308
C -0.406000 0.024425 -0.030804
C -0.932723 -0.752298 1.046694
C 3.182249 -0.169782 0.248389
C 4.091633 -0.817053 1.127821
C 3.685003 0.623470 -0.824212
C 5.483214 -0.677072 0.943326
C 5.074873 0.758068 -1.001172
C 5.980823 0.110832 -0.121577
H -3.764868 2.141737 -1.826579
H -3.934392 0.515326 -2.535074
H -5.402507 1.696391 -0.121706
H -5.953720 0.393904 -1.225358
H -0.872926 1.262977 -1.755105
H -2.707065 -1.474374 2.074581
H -6.452121 -0.930452 0.986017
H -5.527686 -0.005887 2.216543
H -5.040287 -1.677385 1.777206
H -0.221024 -1.232192 1.725977
H 3.679570 -1.420570 1.943705
H 2.969796 1.114179 -1.491400
H 6.177895 -1.179563 1.625732
H 5.461750 1.368259 -1.825841
H 7.061449 0.220726 -0.267203


