%chk=000027965.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027965

0 1
 O    3.194600       1.754700      7.5900003E-02
 N  -0.4163000      -2.369900     -9.7000003E-03
 N   -3.494100      0.5925000     -9.8099999E-02
 C   -1.296900     -0.3770000      0.4145000    
 C   0.1053000     -0.2146000      0.2344000    
 C   -2.274000      0.6882000      0.7156000    
 C   0.6338000      -1.479900     -3.0500000E-02
 C   -1.587100      -1.712900      0.2583000    
 C   0.9783000      0.8908000      0.2715000    
 C    1.997100      -1.695800     -0.2610000    
 C    2.344400      0.6899000      4.2599998E-02
 C    2.843800     -0.5844000     -0.2192000    
 C   -3.163200      0.6944000      -1.516400    
 C   -4.440500       1.634800      0.2881000    
 C    4.574600       1.489100     -0.1657000    
 H   -2.542200      0.5988000       1.776900    
 H   -1.815800       1.678300      0.5936000    
 H   -2.518400      -2.259300      0.3154000    
 H  -0.3338000      -3.364500     -0.1690000    
 H   0.6023000       1.889600      0.4750000    
 H    2.385800      -2.688000     -0.4649000    
 H    3.893200     -0.7921000     -0.4029000    
 H   -4.079200      0.6807000      -2.119300    
 H   -2.569200     -0.1523000      -1.874400    
 H   -2.625200       1.620500      -1.751700    
 H   -5.370900       1.540800     -0.2831000    
 H   -4.039300       2.642100      0.1271000    
 H   -4.713000       1.537300       1.344900    
 H    5.103300       2.445900     -0.1016000    
 H    4.740100       1.101700      -1.176800    
 H    5.001200      0.8381000      0.6050000    


%chk=000027965-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000027965

0 1
O 3.343658 1.734643 0.118543
N -0.423786 -2.384435 -0.067315
N -3.544580 0.638532 -0.100106
C -1.249048 -0.274346 0.250861
C 0.197764 -0.192145 0.144981
C -2.206828 0.864541 0.506605
C 0.690928 -1.533306 -0.055658
C -1.585679 -1.621423 0.119872
C 1.120057 0.882172 0.199524
C 2.064324 -1.807903 -0.200334
C 2.494986 0.605272 0.052772
C 2.970514 -0.727277 -0.145511
C -3.514344 0.702964 -1.576407
C -4.570406 1.535793 0.466888
C 4.779515 1.509782 -0.025248
H -2.361111 0.989858 1.597784
H -1.746207 1.822194 0.146406
H -2.575827 -2.071646 0.138079
H -0.396855 -3.391403 -0.206321
H 0.802490 1.917736 0.353988
H 2.434492 -2.828139 -0.351449
H 4.040437 -0.925926 -0.255539
H -4.502032 0.418208 -1.981820
H -2.761554 -0.004692 -1.962183
H -3.260020 1.723265 -1.962690
H -5.559092 1.280956 0.044293
H -4.379818 2.620341 0.258909
H -4.620779 1.401673 1.562442
H 5.236830 2.507402 0.056950
H 5.027439 1.069557 -1.011904
H 5.173233 0.855253 0.778088


