%chk=000045414.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045414

1 1
 O    3.007900     -0.1095000     -0.1183000    
 N  -0.6697000      0.2599000     -1.8300001E-02
 C  -0.8380000       1.551800      0.5972000    
 C   -1.499700       1.206700     -0.7190000    
 C   0.6618000     -1.1500000E-02 -0.6163000    
 C   -1.332400     -0.8816000      0.6146000    
 C    1.726700      0.1138000      0.4554000    
 C   -1.056600      -2.129600     -0.1952000    
 H  -4.9400002E-02   2.292300      0.5505000    
 H   -1.468600       1.619000       1.475200    
 H   -2.573100       1.061100     -0.7183000    
 H   -1.118600       1.680900      -1.614900    
 H   0.7112000     -0.9500000      -1.171600    
 H   0.8614000      0.7546000      -1.379300    
 H  -0.9330000     -0.9882000       1.629600    
 H   -2.410400     -0.6944000      0.6863000    
 H    1.754000       1.097500      0.9309000    
 H    1.583800     -0.6360000       1.239900    
 H   -1.721100      -2.928900      0.1545000    
 H   -1.263800      -1.994900      -1.262200    
 H  -4.1400000E-02  -2.513000     -4.9899999E-02
 H    3.146800      0.5706000     -0.7993000    


%chk=000045414-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000045414

1 1
O 3.055854 0.280796 -0.377339
N -0.641180 0.322302 -0.061923
C -1.086324 1.709731 0.416702
C -1.679508 1.131667 -0.846997
C 0.743719 0.212133 -0.661121
C -1.145717 -0.890246 0.715686
C 1.846187 0.040020 0.399411
C -1.250319 -2.146667 -0.155930
H -0.321060 2.486681 0.341948
H -1.677168 1.712775 1.336374
H -2.691825 0.720150 -0.823808
H -1.338418 1.498009 -1.818577
H 0.747930 -0.625823 -1.375587
H 0.949555 1.141801 -1.219483
H -0.455238 -1.033015 1.564516
H -2.132476 -0.611203 1.125279
H 1.723548 0.785052 1.216141
H 1.832302 -0.978803 0.838415
H -1.709187 -2.950805 0.444570
H -1.893366 -1.985152 -1.038844
H -0.267318 -2.514718 -0.493523
H 3.867810 0.065913 0.145590


