%chk=000003863.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003863

0 1
 O    3.704100     -0.9754000      -1.079300    
 O    3.216300       1.222000      -1.390200    
 N    2.467400       1.529300       1.215200    
 N   -2.517400      0.1230000      0.3537000    
 N   -4.353700       1.656500      9.6600004E-02
 C   0.3925000     -0.4844000      0.2942000    
 C    1.697800     -0.8194000       1.030100    
 C  -0.7064000      -1.497300      0.6342000    
 C    2.839000      0.1804000      0.7915000    
 C   -2.022900      -1.187900     -6.9799997E-02
 C    3.253800      0.2381000     -0.6651000    
 C   -3.652300      0.4958000     -0.1324000    
 C   -4.318300     -0.4806000      -1.078700    
 H   6.1999999E-02  0.5227000      0.5710000    
 H   0.5632000     -0.4842000     -0.7887000    
 H    2.023700      -1.824100      0.7319000    
 H    1.495500     -0.8709000       2.108200    
 H  -0.3766000      -2.503900      0.3499000    
 H  -0.8687000      -1.505300       1.719300    
 H    3.717700     -0.1259000       1.371600    
 H   -1.832600      -1.217900      -1.148800    
 H   -2.716200      -1.989500      0.2083000    
 H    3.278500       2.143800       1.153300    
 H    2.195100       1.516200       2.197300    
 H    3.984000     -0.9597000      -2.019300    
 H   -3.703800     -0.6716000      -1.962100    
 H   -4.583800      -1.411700     -0.5713000    
 H   -5.258700     -5.5599999E-02  -1.448800    
 H   -5.249700       1.844500     -0.3401000    
 H   -3.988600       2.368100      0.7206000    


%chk=000003863-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003863

0 1
O 3.207415 -0.938778 -1.297018
O 2.545212 1.236360 -1.753690
N 1.919534 1.723306 0.880987
N -2.927939 -0.622586 0.865477
N -4.025880 1.389393 0.502613
C 0.161098 -0.773248 0.426391
C 1.556973 -0.760362 1.078586
C -0.767359 -1.846742 1.032037
C 2.472948 0.404614 0.582234
C -2.195363 -1.822582 0.427482
C 2.718870 0.317452 -0.921123
C -3.332946 0.282822 0.009238
C -3.147498 0.277293 -1.511876
H -0.294337 0.227087 0.550094
H 0.263937 -0.956487 -0.665102
H 2.080559 -1.719496 0.900992
H 1.447580 -0.642347 2.175443
H -0.330251 -2.855806 0.880274
H -0.856383 -1.688052 2.125142
H 3.477088 0.235889 1.044980
H -2.112839 -1.935201 -0.679461
H -2.746308 -2.708735 0.802690
H 2.006984 2.423029 0.142440
H 2.029999 2.057995 1.836041
H 3.371443 -0.941779 -2.278682
H -2.077164 0.203813 -1.771537
H -3.664423 -0.586561 -1.966390
H -3.548242 1.194906 -1.975279
H -4.323025 2.149854 -0.099740
H -4.168784 1.450048 1.509056


