%chk=000014216.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014216

0 1
 O    1.045500     -0.6761000       1.504100    
 N    1.257900      -1.525600     -0.6440000    
 C   0.6133000      0.8001000     -0.3670000    
 C  -0.8152000       1.203000      4.8999999E-02
 C   -1.853100      0.1341000     -0.3133000    
 C    1.611000       1.892700      5.9900001E-02
 C   -3.246800      0.5274000      0.1770000    
 C    1.000100     -0.5288000      0.2842000    
 C    3.046200       1.591700     -0.3519000    
 C   -4.273500     -0.5481000     -0.1411000    
 C    1.614500      -2.870300     -0.2569000    
 H   0.6433000      0.7068000      -1.459700    
 H   -1.083400       2.150000     -0.4355000    
 H  -0.8477000       1.378300       1.132200    
 H   -1.867600     -9.8000001E-03  -1.400400    
 H   -1.586200     -0.8284000      0.1371000    
 H    1.581600       2.030700       1.148000    
 H    1.312700       2.848000     -0.3890000    
 H   -3.553400       1.469800     -0.2913000    
 H   -3.228200      0.6940000       1.260400    
 H    3.695600       2.433600     -9.1300003E-02
 H    3.434400      0.7039000      0.1562000    
 H    3.117600       1.431100      -1.432300    
 H   -4.013600      -1.494600      0.3435000    
 H   -4.338800     -0.7206000      -1.220100    
 H   -5.262900     -0.2446000      0.2152000    
 H    1.158700      -1.331400      -1.635600    
 H    2.212400      -3.314700      -1.055900    
 H   0.6946000      -3.444600     -0.1211000    
 H    2.182900      -2.862300      0.6766000    


%chk=000014216-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014216

0 1
O 1.176548 -0.713844 1.548378
N 1.322044 -1.594476 -0.601647
C 0.611252 0.768437 -0.332137
C -0.812811 1.128712 0.174043
C -1.912980 0.142407 -0.276575
C 1.634131 1.879261 0.035724
C -3.321805 0.555977 0.207712
C 1.057150 -0.566178 0.291793
C 3.041959 1.649791 -0.553333
C -4.424850 -0.426640 -0.240930
C 1.761361 -2.925221 -0.166121
H 0.580747 0.668149 -1.439564
H -1.063832 2.148492 -0.183370
H -0.782442 1.169330 1.280709
H -1.916638 0.067969 -1.385421
H -1.683371 -0.872080 0.107682
H 1.694931 1.933440 1.139575
H 1.234511 2.850664 -0.317667
H -3.553296 1.573372 -0.169166
H -3.315563 0.627806 1.314153
H 3.723843 2.475128 -0.278832
H 3.484510 0.710711 -0.173975
H 3.011658 1.591854 -1.658583
H -4.229055 -1.444123 0.147175
H -4.473172 -0.492600 -1.344626
H -5.420622 -0.112645 0.122566
H 1.206282 -1.411853 -1.599099
H 2.760826 -3.172758 -0.569711
H 1.045333 -3.708858 -0.476255
H 1.815254 -2.904922 0.934501


