%chk=000101511.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101511

0 1
 O    3.126400      0.1229000      0.1224000    
 N  -0.8998000      -1.757100     -1.9900000E-02
 N   -2.794400     -0.5844000      3.8899999E-02
 N    1.903900     -0.4899000     -8.7899998E-02
 N   0.6733000       1.567100     -4.1499998E-02
 N   -1.764900       1.617900      2.4800001E-02
 C  -0.5233000     -0.4442000     -2.1700000E-02
 C   0.6897000      0.2153000     -5.0500002E-02
 C   -1.717000      0.2640000      1.5200000E-02
 C   -2.268800      -1.790600      1.7000001E-02
 C  -0.5358000       2.176500     -4.9000001E-03
 C    4.110700     -0.8975000      8.0000004E-03
 H  -0.2844000      -2.559500     -4.1800000E-02
 H   -2.816500      -2.722100      2.5900001E-02
 H    1.869700      -1.502800     -4.9800001E-02
 H  -0.5124000       3.260900      1.3000000E-03
 H    5.094400     -0.4362000      0.1338000    
 H    4.075300      -1.365400     -0.9818000    
 H    3.982600      -1.650400      0.7931000    


%chk=000101511-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101511

0 1
O 3.124439 -0.638537 0.931902
N -1.219289 -1.930575 0.217446
N -2.812856 -0.357994 -0.268831
N 1.867115 -1.174324 0.434612
N 1.095494 1.036897 -0.041398
N -1.270134 1.583394 -0.435335
C -0.533361 -0.714719 0.083179
C 0.818174 -0.277118 0.188837
C -1.544275 0.257418 -0.222438
C -2.575272 -1.649984 -0.005298
C 0.050379 1.882017 -0.337032
C 3.982915 -0.228761 -0.205880
H -0.827330 -2.853134 0.399824
H -3.337898 -2.425358 0.034408
H 1.662250 -2.030403 0.960352
H 0.329267 2.926640 -0.503594
H 4.932013 0.059406 0.274946
H 3.528743 0.632235 -0.722661
H 4.138325 -1.072602 -0.902440


