%chk=000035370.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035370

0 1
 O   0.9179000      0.5315000       1.016200    
 O    1.434000       3.251600      0.6483000    
 O   -1.399300      -2.836800      0.4450000    
 O   -5.000200     -7.3500000E-02 -0.2948000    
 N  -0.9903000     -0.5506000      0.2031000    
 N    3.376200      -1.075100      1.8800000E-02
 N   -3.186200      -1.447200      7.5000003E-02
 N    4.593700     -0.8733000     -0.1225000    
 N    5.713900     -0.6970000     -0.2456000    
 C    2.491000     -0.1125000     -0.6492000    
 C   0.4293000     -0.6519000      0.3715000    
 C    1.168200     -0.7776000     -0.9488000    
 C    2.107800      0.9803000      0.3408000    
 C    1.788000       2.303900     -0.3432000    
 C   -1.548200      0.7051000     -1.5600000E-02
 C   -1.820600      -1.693900      0.2554000    
 C   -2.855200      0.9375000     -0.1879000    
 C   -3.789800     -0.2184000     -0.1449000    
 C   -3.429900       2.297700     -0.4216000    
 H    2.964900      0.2740000      -1.559700    
 H   0.6659000      -1.502400       1.022000    
 H   0.6532000     -0.2222000      -1.742800    
 H    1.251900      -1.818200      -1.278800    
 H    2.872300       1.145800       1.108700    
 H   0.9645000       2.226900      -1.058100    
 H    2.665400       2.684100     -0.8757000    
 H  -0.8711000       1.545800     -5.6000002E-02
 H   -3.800300      -2.256200      0.1093000    
 H   0.6725000       2.896800       1.137800    
 H   -3.950400       2.332600      -1.384100    
 H   -2.656400       3.072800     -0.4338000    
 H   -4.143100       2.552500      0.3692000    


%chk=000035370-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000035370

0 1
O 0.982700 0.473977 0.963179
O 1.561555 3.206182 1.051421
O -1.298082 -2.731348 0.903459
O -5.144071 -0.202625 0.093690
N -1.037964 -0.517331 0.117895
N 3.348720 -1.202813 -0.473893
N -3.188784 -1.415007 0.486650
N 4.547997 -1.020194 -0.102533
N 5.677175 -1.057575 0.262301
C 2.525884 -0.003407 -0.859732
C 0.426351 -0.643683 0.153217
C 1.125960 -0.536179 -1.220516
C 2.251901 0.951476 0.337377
C 2.041507 2.418359 -0.078590
C -1.641073 0.684555 -0.272811
C -1.807031 -1.638003 0.537857
C -2.999765 0.879285 -0.311099
C -3.880487 -0.233522 0.085178
C -3.644722 2.178771 -0.723135
H 3.006002 0.530318 -1.703577
H 0.643841 -1.603312 0.650449
H 0.598479 0.178751 -1.875369
H 1.179869 -1.511891 -1.725913
H 3.034600 0.890720 1.115401
H 1.334114 2.474892 -0.937341
H 2.998658 2.877637 -0.380849
H -0.944204 1.487868 -0.525672
H -3.772292 -2.206888 0.776080
H 0.845038 2.682133 1.498884
H -4.318521 2.024766 -1.585238
H -2.890700 2.938097 -0.992127
H -4.273051 2.578090 0.093358


