%chk=000110804.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110804

0 1
 O    3.797400       2.525700      0.2079000    
 N    2.421700      0.5861000     -1.1400000E-02
 N  -0.9141000       1.939400     -0.3794000    
 C   0.3710000       1.676000      0.2416000    
 C    1.001300      0.3761000     -0.2290000    
 C    1.423300       2.714900     -0.1137000    
 C    2.721700       1.960800      7.4900001E-02
 C   -1.889600      0.9164000     -2.1500001E-02
 C    3.354900     -0.4921000      2.1700000E-02
 C   -3.254900       1.221600     -0.6385000    
 C   -4.279200      0.1825000     -0.2575000    
 C    4.722700     -0.2347000      0.1510000    
 C    2.907800      -1.813000     -7.5700000E-02
 C    5.635500      -1.288900      0.1829000    
 C    3.820700      -2.867200     -4.3800000E-02
 C   -4.446200     -0.9356000      -1.060700    
 C   -5.037400      0.3619000      0.8896000    
 C    5.184600      -2.605200      8.5500002E-02
 C   -5.393600      -1.896800     -0.7085000    
 C   -5.984800     -0.5993000       1.241800    
 C   -6.163000      -1.728700      0.4428000    
 H   0.2687000       1.658300       1.336400    
 H   0.6226000     -0.4591000      0.3675000    
 H   0.8446000      0.1872000      -1.297700    
 H    1.376900       3.586300      0.5452000    
 H    1.362700       3.037400      -1.159300    
 H   -1.253700       2.856400     -9.0599999E-02
 H   -1.566600     -6.9499999E-02 -0.3762000    
 H   -1.988300      0.8561000       1.070100    
 H   -3.174800       1.274200      -1.732500    
 H   -3.605800       2.211900     -0.3185000    
 H    5.141100      0.7595000      0.2302000    
 H    1.859800      -2.069500     -0.1908000    
 H    6.697900      -1.085900      0.2831000    
 H    3.470500      -3.892300     -0.1228000    
 H   -3.850500      -1.076400      -1.958200    
 H   -4.904700       1.236900       1.519500    
 H    5.895400      -3.426000      0.1094000    
 H   -5.531900      -2.776400      -1.330300    
 H   -6.583400     -0.4688000       2.138500    
 H   -6.900500      -2.477200      0.7172000    


%chk=000110804-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000110804

0 1
O 3.881261 2.552151 0.171495
N 2.550987 0.572783 0.048368
N -0.898286 1.721168 -0.390426
C 0.377522 1.555470 0.330854
C 1.108209 0.241019 -0.071043
C 1.402453 2.651245 -0.020917
C 2.768652 1.964149 0.086988
C -1.987969 0.818530 0.045782
C 3.549941 -0.447856 0.017607
C -3.288385 1.113733 -0.742110
C -4.427852 0.196220 -0.324560
C 4.918037 -0.160772 0.291672
C 3.172612 -1.785417 -0.289691
C 5.870942 -1.199430 0.262018
C 4.139447 -2.812536 -0.313094
C -4.699294 -0.999436 -1.038058
C -5.218164 0.496983 0.815202
C 5.495295 -2.529982 -0.035834
C -5.730458 -1.873299 -0.623876
C -6.250153 -0.372577 1.233414
C -6.509217 -1.563010 0.514907
H 0.236435 1.540196 1.439929
H 0.855573 -0.603103 0.593931
H 0.843425 -0.026106 -1.113303
H 1.371196 3.536831 0.633501
H 1.258568 2.985325 -1.067505
H -1.205386 2.704555 -0.379843
H -1.681145 -0.227829 -0.145514
H -2.198485 0.894661 1.141982
H -3.068513 1.007788 -1.820066
H -3.571509 2.172527 -0.569803
H 5.215927 0.865749 0.511021
H 2.133009 -2.031411 -0.525241
H 6.919135 -0.961585 0.475863
H 3.828228 -3.835384 -0.553653
H -4.103242 -1.243031 -1.926646
H -5.029434 1.423404 1.372858
H 6.244090 -3.328951 -0.054672
H -5.929124 -2.790389 -1.190162
H -6.853546 -0.121794 2.113340
H -7.310981 -2.237589 0.835490


