%chk=000108079.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108079

0 1
 O   -3.622800      0.8175000       1.403300    
 O   -1.131500      -1.423900      0.7132000    
 O    3.052700       1.807500     -0.7400000    
 O    3.983400      0.8750000       1.105400    
 N   -1.900100      0.5406000     -0.2552000    
 N    3.904700      -1.580500     -0.1439000    
 C   -3.283400      0.3673000      8.4100001E-02
 C   -4.037200     -0.8246000     -0.4123000    
 C   -4.343300      0.5400000     -0.9564000    
 C  -0.9253000     -0.3839000      9.3300000E-02
 C   0.4514000      4.7400001E-02 -0.3821000    
 C    1.539900     -0.9601000     -6.8000001E-03
 C    2.921600     -0.5711000     -0.5445000    
 C    3.389800      0.7487000      4.1700002E-02
 H   -4.768300      -1.281100      0.2441000    
 H   -3.538900      -1.523600      -1.073400    
 H   -4.040000      0.7542000      -1.974200    
 H   -5.280500      0.9992000     -0.6662000    
 H   -1.641400       1.381500     -0.7643000    
 H   -3.075200      0.3667000       2.068100    
 H   0.4151000      0.1720000      -1.470700    
 H   0.6593000       1.024500      6.7900002E-02
 H    1.570800      -1.051300       1.087800    
 H    1.263600      -1.950000     -0.3936000    
 H    2.921100     -0.5007000      -1.637600    
 H    3.638500      -2.485200     -0.5317000    
 H    3.888300      -1.698000      0.8691000    
 H    3.346000       2.658200     -0.3493000    


%chk=000108079-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108079

0 1
O -3.463921 -0.488090 1.421320
O -1.229906 -1.719273 0.209037
O 3.085880 1.374991 -1.509621
O 4.138827 1.327293 0.557720
N -1.946326 0.435085 -0.233640
N 3.957407 -1.460594 0.536976
C -3.318958 0.094313 0.119677
C -4.273104 -0.362882 -0.991884
C -4.432082 1.021128 -0.312370
C -0.957456 -0.530129 -0.166381
C 0.450045 -0.095493 -0.573832
C 1.526181 -0.739620 0.329406
C 2.982017 -0.702160 -0.254292
C 3.479993 0.737696 -0.326626
H -4.996572 -1.138370 -0.728271
H -3.893691 -0.394660 -2.016789
H -4.183324 1.914432 -0.893909
H -5.250717 1.143170 0.400662
H -1.696213 1.414344 -0.383702
H -2.940641 -1.339819 1.394132
H 0.610804 -0.428423 -1.619556
H 0.536056 1.006573 -0.584884
H 1.526615 -0.273056 1.333384
H 1.256361 -1.803962 0.465377
H 2.941050 -1.095365 -1.288039
H 3.666205 -2.410212 0.778014
H 4.360812 -0.933341 1.317007
H 3.422956 2.312724 -1.503116


