%chk=000035944.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035944

0 1
 O    4.561000      0.8922000     -9.6799999E-02
 O    2.909800       2.301200     -0.4242000    
 N    3.335300       1.145200     -0.1863000    
 N   -3.680900       2.349400      0.5818000    
 C   0.1156000     -0.6904000      6.1400000E-02
 C   -1.303000     -0.4242000     -3.8600001E-02
 C    1.032900      0.3466000     -0.1084000    
 C   -1.804800      0.8275000      0.3182000    
 C   0.5657000      -1.983800      0.3261000    
 C   -2.168900      -1.419300     -0.4922000    
 C    2.400600      8.9900002E-02 -1.3500000E-02
 C   -3.172600       1.083900      0.2214000    
 C    1.933300      -2.240400      0.4210000    
 C    2.850800      -1.203600      0.2513000    
 C   -3.536500      -1.163000     -0.5889000    
 C   -4.038300      8.8600002E-02 -0.2322000    
 H   0.6936000       1.350200     -0.3512000    
 H   -1.163800       1.614900      0.7074000    
 H  -0.1116000      -2.816300      0.4959000    
 H   -1.820600      -2.398100     -0.8103000    
 H    2.283800      -3.246100      0.6341000    
 H    3.908500      -1.440400      0.3337000    
 H   -4.210200      -1.935200     -0.9488000    
 H   -5.105900      0.2766000     -0.3137000    
 H   -3.054800       3.071900      0.9111000    
 H   -4.672700       2.534700      0.5123000    


%chk=000035944-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000035944

0 1
O 4.680275 0.883545 -0.128173
O 2.958938 2.333777 -0.486917
N 3.421268 1.155904 -0.224701
N -3.748494 2.358900 0.622292
C 0.125056 -0.701385 0.061942
C -1.338259 -0.431140 -0.044906
C 1.074361 0.334367 -0.132007
C -1.859459 0.829901 0.335734
C 0.613089 -2.005015 0.364284
C -2.224681 -1.430805 -0.532392
C 2.449639 0.051411 -0.017532
C -3.249928 1.114631 0.237259
C 1.996235 -2.268943 0.466124
C 2.940184 -1.239048 0.277315
C -3.604956 -1.152102 -0.630779
C -4.124703 0.100919 -0.253727
H 0.766245 1.348772 -0.398116
H -1.189243 1.594434 0.747824
H -0.102716 -2.813291 0.546835
H -1.837240 -2.397402 -0.869647
H 2.339023 -3.280758 0.705383
H 4.016983 -1.407975 0.353059
H -4.285257 -1.919295 -1.017467
H -5.199838 0.301389 -0.335582
H -3.128708 3.088421 0.961831
H -4.741515 2.562790 0.562664


