%chk=000026324.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026324

0 1
 O   -2.967900      0.5329000     -0.7210000    
 O    2.207600     -0.8299000      -1.818000    
 O   -3.408000      -1.748200      0.8053000    
 N    2.560800      0.4677000      9.4099998E-02
 C    3.926300      0.8554000     -0.2306000    
 C    2.034400      0.9969000       1.350400    
 C    1.797600     -0.3625000     -0.7473000    
 C   0.4459000     -0.7190000     -0.3465000    
 C    4.905100     -0.1524000      0.3409000    
 C    1.357100       2.332700       1.111500    
 C  -0.6295000      8.3499998E-02 -0.7275000    
 C   0.2248000      -1.863800      0.4193000    
 C   -1.925900     -0.2587000     -0.3428000    
 C   -2.146800      -1.403500      0.4229000    
 C   -1.071400      -2.206100      0.8040000    
 C   -2.943800       1.889700     -0.2819000    
 C   -4.366400       2.385200     -0.1328000    
 H    4.035200      0.8797000      -1.320400    
 H    4.129400       1.862700      0.1474000    
 H    1.322900      0.3001000       1.800400    
 H    2.856000       1.110000       2.066600    
 H  -0.4573000      0.9640000      -1.341900    
 H    4.833500     -0.2040000       1.432100    
 H    4.714500      -1.156500     -5.2600000E-02
 H    5.931100      0.1257000      8.0799997E-02
 H    2.067400       3.070100      0.7226000    
 H   0.5340000       2.268700      0.3982000    
 H   0.9552000       2.722200       2.052300    
 H    1.055600      -2.496000      0.7221000    
 H   -1.229300      -3.100500       1.400900    
 H   -2.426600       1.982200      0.6814000    
 H   -2.414800       2.495100      -1.026000    
 H   -4.384800       3.429100      0.1926000    
 H   -4.905600       2.301400      -1.082000    
 H   -4.911100       1.777600      0.5975000    
 H   -3.367700      -2.567000       1.328700    


%chk=000026324-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026324

0 1
O -3.070229 0.481144 0.134414
O 2.509541 -1.391112 -1.214816
O -3.611192 -2.090691 0.637584
N 2.407551 0.548069 0.065022
C 3.789965 0.863599 -0.381165
C 1.916984 1.279893 1.257122
C 1.837629 -0.623078 -0.446281
C 0.411657 -0.966637 -0.099698
C 4.871821 0.104746 0.418853
C 1.539860 2.752023 0.982214
C -0.636498 -0.006703 -0.101379
C 0.099947 -2.326664 0.123153
C -1.975096 -0.388942 0.135840
C -2.271053 -1.762174 0.394897
C -1.230805 -2.716014 0.381459
C -2.809735 1.903973 -0.159646
C -4.159425 2.614269 -0.111162
H 3.866119 0.587124 -1.445855
H 3.934866 1.956171 -0.293795
H 1.051589 0.737865 1.670381
H 2.710963 1.250577 2.032102
H -0.403967 1.036211 -0.330842
H 4.813533 0.325426 1.500882
H 4.753272 -0.981118 0.269332
H 5.879044 0.396439 0.068538
H 2.401568 3.330396 0.603925
H 0.730585 2.828229 0.234300
H 1.196163 3.234005 1.916084
H 0.901614 -3.068872 0.074290
H -1.466116 -3.772413 0.566622
H -2.109091 2.316381 0.597260
H -2.341641 1.994922 -1.162012
H -4.030234 3.691174 -0.324069
H -4.848584 2.187556 -0.859254
H -4.620509 2.504750 0.885029
H -3.702595 -3.066026 0.781372


