%chk=000004593.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004593

0 1
 O    4.756400     -0.8113000     -0.3107000    
 N   -2.865500      0.2541000     -0.6481000    
 N    2.639100      -1.699700     -0.2039000    
 N   -4.801300      0.4506000      0.4535000    
 N    4.464200       2.792900      3.5900000E-02
 C  -0.7099000     -0.1459000      0.2679000    
 C   0.7171000     -0.3436000      9.6199997E-02
 C    1.267400      -1.570000     -6.9200002E-02
 C   -1.495300      6.3199997E-02 -0.8104000    
 C   -3.506800      0.2450000      0.5846000    
 C   -1.367400     -0.1599000       1.581200    
 C    1.621200      0.8058000      0.1161000    
 C   -2.692800      2.5400000E-02   1.730100    
 C   -3.830900      0.4797000      -1.596100    
 C    2.951300      0.7018000     -1.4800000E-02
 C   0.5334000      -2.882700     -0.1423000    
 C    3.543200     -0.6554000     -0.1888000    
 C   -5.007700      0.5970000     -0.8946000    
 C    3.784400       1.853200      1.3200000E-02
 H   -1.114300      9.2799999E-02  -1.826000    
 H  -0.7444000     -0.3279000       2.454900    
 H    1.160300       1.782900      0.2474000    
 H   -3.149500      9.4999997E-03   2.713400    
 H    3.007600      -2.639300     -0.3252000    
 H   -3.603900      0.5356000      -2.651900    
 H  -0.5500000      -2.777000     -4.0199999E-02
 H   0.8727000      -3.550700      0.6569000    
 H   0.7249000      -3.370600      -1.104300    
 H   -5.994700      0.7794000      -1.293700    


%chk=000004593-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004593

0 1
O 4.873807 -0.736163 -0.275863
N -2.858595 0.557668 -0.660814
N 2.758979 -1.664559 0.069681
N -4.915621 0.315183 0.350409
N 4.244217 2.906910 -0.836105
C -0.773603 -0.299794 0.192216
C 0.706980 -0.424489 0.065435
C 1.381547 -1.652991 0.191008
C -1.486791 0.391193 -0.788112
C -3.591012 0.026135 0.463471
C -1.484236 -0.829560 1.334753
C 1.498071 0.742316 -0.204786
C -2.862929 -0.671160 1.464454
C -3.795108 1.192218 -1.481509
C 2.889814 0.709546 -0.338383
C 0.729773 -2.996776 0.423754
C 3.626028 -0.554252 -0.192869
C -5.033713 1.027852 -0.839548
C 3.635905 1.902380 -0.608195
H -1.015324 0.804758 -1.683129
H -0.917959 -1.332230 2.124654
H 0.986840 1.707394 -0.291375
H -3.414559 -1.054507 2.325848
H 3.260187 -2.556546 0.155706
H -3.518857 1.686255 -2.408724
H -0.339710 -2.966283 0.169764
H 0.815804 -3.307949 1.482286
H 1.210581 -3.778063 -0.193048
H -6.001718 1.390413 -1.179880


