%chk=000040918.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040918

0 1
 O   0.2380000     -0.4457000      0.1651000    
 O   -3.558900      -1.791500     -0.5697000    
 O   -1.154800      -2.205000      0.6787000    
 N    4.372600      0.9236000      0.9356000    
 C    1.382100      -1.289300      0.3351000    
 C    2.624100     -0.4884000      7.5700000E-02
 C   -2.065100     -6.2799998E-02  0.1618000    
 C   -3.314600     -0.4786000     -0.2982000    
 C  -0.9868000      -1.020200      0.3653000    
 C   -1.835300       1.285900      0.4333000    
 C    3.157600     -0.4111000      -1.198700    
 C    3.253200      0.1843000       1.101800    
 C   -4.334200      0.4545000     -0.4866000    
 C   -2.854900       2.219000      0.2447000    
 C   -4.104400       1.803300     -0.2152000    
 C    4.308800      0.3398000      -1.409500    
 C    4.872600      0.9823000     -0.3191000    
 H    1.323700      -2.135100     -0.3612000    
 H    1.396100      -1.690600       1.356000    
 H  -0.8777000       1.640300      0.8059000    
 H    2.691300     -0.9245000      -2.034500    
 H    2.873800      0.1573000       2.118300    
 H   -5.312600      0.1450000     -0.8444000    
 H   -2.677300       3.268800      0.4591000    
 H   -4.898400       2.529700     -0.3612000    
 H    4.750300      0.4202000      -2.396200    
 H    5.770800       1.580800     -0.4306000    
 H   -4.476800      -1.887100     -0.8768000    


%chk=000040918-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040918

0 1
O 0.157786 -0.357027 1.144133
O -2.971742 -1.424622 -1.570498
O -0.388025 -1.745130 -0.651243
N 4.496867 0.987741 0.380056
C 1.439682 -1.121795 1.296146
C 2.552989 -0.515922 0.471485
C -1.900845 0.080455 0.017431
C -3.009966 -0.247840 -0.821675
C -0.685793 -0.777540 0.087840
C -1.971973 1.276352 0.786247
C 2.726124 -0.838074 -0.899755
C 3.469471 0.395338 1.056176
C -4.139061 0.610120 -0.876615
C -3.090733 2.127076 0.729931
C -4.179660 1.789143 -0.108886
C 3.782694 -0.235456 -1.615719
C 4.637059 0.668285 -0.941286
H 1.250228 -2.170813 1.009500
H 1.649343 -1.046404 2.375010
H -1.120351 1.520545 1.425441
H 2.035269 -1.536593 -1.383679
H 3.380049 0.666275 2.116337
H -4.985493 0.346619 -1.524671
H -3.115961 3.042857 1.328155
H -5.058184 2.440968 -0.165459
H 3.946287 -0.458933 -2.674635
H 5.466473 1.157791 -1.464688
H -3.809333 -1.528517 -2.090579


