%chk=000011959.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011959

0 1
 O    1.495800       1.329500     -0.3800000    
 N    1.736400     -0.8886000      0.2516000    
 C  -0.4697000      9.7599998E-02 -3.7099998E-02
 C    3.181300     -0.8995000      0.2781000    
 C   0.9769000      0.2395000     -7.9899997E-02
 C   -1.273100       1.211300      0.2075000    
 C   -1.053900      -1.152600     -0.2404000    
 C    3.753400      0.4525000     -9.5200002E-02
 C   -2.660700       1.074800      0.2490000    
 C   -2.441500      -1.289100     -0.1991000    
 C   -3.244800     -0.1754000      4.5600001E-02
 H    3.491200      -1.188500       1.287100    
 H    3.518900      -1.673400     -0.4180000    
 H    1.278600      -1.744300      0.5459000    
 H  -0.8376000       2.193300      0.3729000    
 H  -0.4690000      -2.039500     -0.4653000    
 H    3.529800      0.7443000      -1.126600    
 H    3.501300       1.239600      0.6230000    
 H    4.847900      0.3751000     -5.5500001E-02
 H   -3.286500       1.941700      0.4402000    
 H   -2.897400      -2.261000     -0.3646000    
 H   -4.325300     -0.2814000      7.6200001E-02


%chk=000011959-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011959

0 1
O 1.242137 1.671148 0.993142
N 1.788966 -0.501568 0.359493
C -0.569450 0.210097 0.287710
C 3.238266 -0.324925 0.551565
C 0.880684 0.526790 0.568821
C -1.544402 1.047319 0.887750
C -0.993689 -0.849431 -0.557000
C 4.027938 -0.399979 -0.772270
C -2.918307 0.815487 0.670637
C -2.369823 -1.078717 -0.778462
C -3.335788 -0.251647 -0.159875
H 3.365876 0.665000 1.021622
H 3.608154 -1.088734 1.263315
H 1.444807 -1.424383 0.092474
H -1.194841 1.876097 1.511972
H -0.263648 -1.479170 -1.080690
H 3.898575 -1.379382 -1.270188
H 3.692374 0.389193 -1.467001
H 5.107397 -0.258343 -0.580308
H -3.662849 1.465079 1.143746
H -2.687450 -1.892916 -1.439201
H -4.402929 -0.431117 -0.331849


