%chk=000114551.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114551

0 1
 N    3.534100     -0.8619000      0.4645000    
 C    1.167600     -0.3826000     -0.1028000    
 C    1.494400       1.111200     -0.2222000    
 C    2.412300      -1.231200     -0.4010000    
 C    2.714500       1.462800      0.6243000    
 C   1.7600000E-02 -0.7606000      -1.034000    
 C    3.893200      0.5470000      0.3039000    
 C   -1.313400     -0.3546000     -0.4637000    
 C   -2.011900      -1.242000      0.3446000    
 C   -1.827900      0.9027000     -0.7526000    
 C   -3.246500     -0.8654000      0.8733000    
 C   -3.062400       1.279300     -0.2236000    
 C   -3.771700      0.3952000      0.5894000    
 H   0.8755000     -0.5862000      0.9380000    
 H   0.6561000       1.729100      0.1135000    
 H    1.694100       1.373900      -1.268900    
 H    2.182200      -2.289500     -0.2318000    
 H    2.704400      -1.132600      -1.454300    
 H    2.998000       2.506700      0.4488000    
 H    2.458700       1.375400       1.688000    
 H   4.0000002E-03  -1.846800      -1.196700    
 H   0.1531000     -0.3233000      -2.031900    
 H    4.250300      0.7309000     -0.7168000    
 H    4.722800      0.7802000      0.9801000    
 H    4.340300      -1.442400      0.2351000    
 H   -1.611200      -2.225300      0.5744000    
 H   -1.290700       1.597000      -1.392400    
 H   -3.798700      -1.553400       1.506700    
 H   -3.472500       2.260000     -0.4466000    
 H   -4.733200      0.6883000       1.000900    


%chk=000114551-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114551

0 1
N 3.648663 -0.855629 0.246117
C 1.215948 -0.509889 -0.117163
C 1.444210 1.016107 0.024643
C 2.510313 -1.179688 -0.639730
C 2.687984 1.321445 0.892329
C 0.015456 -0.845916 -1.049380
C 3.928603 0.595143 0.330941
C -1.325907 -0.367076 -0.511865
C -1.949778 -1.040389 0.572088
C -1.976630 0.768355 -1.058875
C -3.183044 -0.592087 1.094607
C -3.211285 1.222534 -0.540053
C -3.819586 0.543674 0.540219
H 1.013817 -0.926683 0.890860
H 0.545163 1.498161 0.451604
H 1.590666 1.448463 -0.989515
H 2.382895 -2.279137 -0.662258
H 2.675101 -0.838854 -1.697329
H 2.876103 2.412073 0.927493
H 2.513341 0.973699 1.928574
H -0.013652 -1.945611 -1.193045
H 0.203595 -0.397549 -2.045555
H 4.177550 1.041107 -0.667746
H 4.800193 0.750214 0.993546
H 4.486717 -1.408560 0.026936
H -1.466113 -1.925668 1.004798
H -1.512228 1.299187 -1.899318
H -3.649896 -1.128552 1.928869
H -3.697478 2.101670 -0.978624
H -4.777620 0.891355 0.943031


