%chk=000154305.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154305

0 1
 O    4.605900      0.7388000      0.2158000    
 O   -4.618200      0.7224000     -0.2262000    
 O    1.159000      -1.434100     -0.9078000    
 O   -1.135600      -1.381100      0.9197000    
 O    3.964700      -1.247200     -0.7434000    
 O   -3.945000      -1.204500      0.8277000    
 N    2.406700      0.3330000     -3.7700001E-02
 N   -2.411600      0.3318000     -1.5500000E-02
 C  -2.6000000E-03  0.5020000     -6.7199998E-02
 C    1.226800     -0.3259000     -0.3816000    
 C   -1.220900     -0.3057000      0.3314000    
 C    5.978800      0.3569000      7.4400000E-02
 C   -5.985500      0.3496000     -2.0500001E-02
 C    3.686900     -0.1644000     -0.2385000    
 C   -3.684300     -0.1531000      0.2520000    
 C    6.856800       1.461400      0.6228000    
 C   -6.881800       1.420200     -0.6054000    
 H   0.2036000       1.194500      0.7570000    
 H  -0.2202000       1.099700     -0.9600000    
 H    2.342300       1.253800      0.3879000    
 H   -2.360600       1.226000     -0.4961000    
 H    6.205300      0.1957000     -0.9854000    
 H    6.158800     -0.5698000      0.6305000    
 H   -6.179100      0.2509000       1.053400    
 H   -6.181000     -0.6081000     -0.5157000    
 H    6.674600       2.399700      8.8600002E-02
 H    6.628900       1.647000       1.677700    
 H    7.915100       1.202100      0.5304000    
 H   -6.684800       2.388100     -0.1329000    
 H   -6.686700       1.543500      -1.675800    
 H   -7.936400       1.166800     -0.4655000    


%chk=000154305-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154305

0 1
O 3.940054 0.311312 0.282358
O -4.154639 0.288956 -0.061789
O 1.587639 2.355820 -2.686056
O -0.025582 0.788621 0.964627
O 4.187070 1.207396 -1.877883
O -2.606553 -0.478822 1.538065
N 2.157878 1.354309 -0.621927
N -2.049736 1.078290 -0.192309
C -0.081438 2.368334 -0.909717
C 1.305350 2.011408 -1.514155
C -0.692346 1.336170 0.043562
C 5.354643 -0.166049 0.234303
C -5.219009 -0.560228 0.561147
C 3.498024 0.986558 -0.864561
C -2.895186 0.212996 0.547929
C 5.618118 -0.880348 1.555398
C -6.491850 -0.330360 -0.244777
H 0.057586 3.304869 -0.332640
H -0.735191 2.603595 -1.764648
H 1.746115 1.062445 0.284021
H -2.508201 1.549815 -0.976294
H 6.011935 0.709849 0.085838
H 5.466027 -0.833808 -0.639106
H -5.323617 -0.257843 1.618543
H -4.880031 -1.611252 0.531220
H 5.482057 -0.194770 2.408984
H 4.933886 -1.736165 1.683336
H 6.656651 -1.258015 1.573624
H -6.795764 0.729706 -0.212660
H -6.352394 -0.624314 -1.298906
H -7.311597 -0.938476 0.178573


