%chk=000098177.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098177

0 1
 O    3.204100      0.8856000     -4.2800002E-02
 O   -3.963000      0.1936000     -0.1655000    
 N  -0.3165000     -0.2354000      0.2368000    
 C   0.8189000      0.5981000     -0.1339000    
 C    2.148600      2.0999999E-03  0.3349000    
 C   -1.570300      0.3749000     -0.1845000    
 C    2.444100      -1.359100     -0.2818000    
 C   -2.766000     -0.4597000      0.2367000    
 H   0.8524000      0.7367000      -1.222400    
 H   0.7138000       1.601600      0.2991000    
 H    2.165700     -8.4799998E-02   1.427600    
 H  -0.3239000     -0.3760000       1.246700    
 H   -1.586900      0.4968000      -1.274800    
 H   -1.674800       1.381300      0.2411000    
 H    3.436500      -1.707600      2.5000000E-02
 H    2.458800      -1.298300      -1.375600    
 H    1.708600      -2.111100      1.8300001E-02
 H   -2.800400     -0.5804000       1.324400    
 H   -2.743800      -1.455700     -0.2180000    
 H    3.037000       1.742300      0.3857000    
 H   -3.941500      0.2747000      -1.134300    


%chk=000098177-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000098177

0 1
O 3.349809 0.800062 0.007656
O -4.062744 -0.004056 -0.196890
N -0.318841 -0.043254 0.360833
C 0.878451 0.688691 -0.094674
C 2.175762 -0.030791 0.346361
C -1.606860 0.448315 -0.170610
C 2.384560 -1.371742 -0.356395
C -2.749031 -0.504286 0.234341
H 0.862498 0.740916 -1.200145
H 0.911878 1.747684 0.278215
H 2.134213 -0.186802 1.450463
H -0.342080 -0.130944 1.386869
H -1.527366 0.477066 -1.276832
H -1.871095 1.481238 0.162631
H 3.274191 -1.887281 0.043378
H 2.537523 -1.204540 -1.437561
H 1.493909 -2.007399 -0.215089
H -2.831422 -0.565914 1.334048
H -2.542924 -1.521019 -0.157929
H 3.247771 1.691606 0.430670
H -4.096804 0.002050 -1.186638


