%chk=000041578.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041578

0 1
 O  -0.7770000       1.523300      -1.641300    
 O    4.238000      -1.314400       1.615400    
 N   4.0300000E-02  0.6675000      0.3817000    
 C   -2.218600       1.589800      0.2659000    
 C   -2.925000      0.3463000      0.8305000    
 C   -3.221500     -0.7008000     -0.2486000    
 C   -3.844700      -1.959000      0.3566000    
 C   -1.989600       2.628900       1.364100    
 C  -0.9038000       1.258000     -0.4475000    
 C   -4.104200      -3.017100     -0.7038000    
 C    1.346000      0.2421000      3.8300000E-02
 C    2.148800     -0.3315000       1.010200    
 C    1.793100      0.4103000      -1.261600    
 C    3.436100     -0.7491000      0.6722000    
 C    3.080300     -7.3000002E-03  -1.599500    
 C    3.901700     -0.5870000     -0.6327000    
 H   -2.876900       2.044200     -0.4870000    
 H   -3.868600      0.6503000       1.301400    
 H   -2.316800     -0.1113000       1.620300    
 H   -3.898100     -0.2739000     -0.9986000    
 H   -2.298700     -0.9821000     -0.7688000    
 H   -3.177900      -2.375300       1.120800    
 H   -4.788600      -1.704800      0.8526000    
 H   -1.441300       3.493000      0.9732000    
 H   -2.945500       2.986500       1.761000    
 H   -1.412400       2.221400       2.200800    
 H   -3.173000      -3.318500      -1.193900    
 H   -4.791100      -2.643900      -1.470100    
 H   -4.552300      -3.906600     -0.2499000    
 H  -0.2152000      0.5132000       1.353800    
 H    1.790100     -0.4595000       2.028200    
 H    1.221300      0.8488000      -2.065500    
 H    3.444300      0.1184000      -2.615200    
 H    4.902600     -0.9081000     -0.9089000    
 H    5.091200      -1.542700       1.207900    


%chk=000041578-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041578

0 1
O -0.778362 1.592367 -1.688546
O 4.209205 -1.317529 1.702361
N 0.067164 0.703017 0.313161
C -2.235327 1.602434 0.297570
C -2.904248 0.315660 0.860395
C -3.215481 -0.752152 -0.211354
C -3.922522 -1.998811 0.367837
C -2.020270 2.666486 1.405771
C -0.926792 1.304625 -0.463507
C -4.232295 -3.062691 -0.707091
C 1.378430 0.293082 -0.059941
C 2.176542 -0.303446 0.949899
C 1.895133 0.455805 -1.375483
C 3.482131 -0.734980 0.646659
C 3.206155 0.014204 -1.648990
C 4.014394 -0.582232 -0.656369
H -2.901741 2.028980 -0.474767
H -3.845908 0.614848 1.364876
H -2.267430 -0.131773 1.654829
H -3.849823 -0.302386 -1.002365
H -2.276925 -1.065125 -0.711848
H -3.285243 -2.445650 1.158517
H -4.864071 -1.688185 0.865645
H -1.525832 3.569031 1.005461
H -2.993175 2.969800 1.833487
H -1.400850 2.280003 2.238081
H -3.304113 -3.410786 -1.197978
H -4.891150 -2.649987 -1.494171
H -4.736563 -3.944740 -0.271672
H -0.182788 0.524478 1.289130
H 1.803489 -0.440966 1.971101
H 1.272889 0.915652 -2.143607
H 3.606827 0.138446 -2.661015
H 5.032037 -0.919281 -0.890114
H 5.109512 -1.589099 1.396037


