%chk=000003433.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003433

0 1
 O    2.770300     -0.8474000      0.3953000    
 O   0.5896000      -2.625200     -0.8822000    
 O   -3.475300      -1.206000      0.9908000    
 N   0.1638000     -0.3397000     -0.7802000    
 N   -1.445400      -1.944700      5.6899998E-02
 N   -2.523600       1.563300      0.4141000    
 N  -0.5573000       2.001100     -0.5411000    
 C  -0.7311000      0.6506000     -0.3989000    
 C   -1.932100      0.3540000      0.1856000    
 C    1.431900      2.6400000E-02  -1.399000    
 C  -0.1667000      -1.700900     -0.5630000    
 C   -2.392500     -0.9676000      0.4639000    
 C   -1.657500       2.524100     -4.0300000E-02
 C    2.519000      0.2231000     -0.3761000    
 C   -1.803600      -3.339600      0.2901000    
 C   -1.988300       3.958200      5.3900000E-02
 C    3.301700       1.283900     -8.1200004E-02
 C    4.129700      0.8445000      0.9793000    
 C    3.767400     -0.4581000       1.232300    
 H    1.301500      0.9301000      -2.005900    
 H    1.741100     -0.7734000      -2.082400    
 H   -3.428500       1.721000      0.8380000    
 H   -2.782000      -3.452500      0.7625000    
 H   -1.039400      -3.794300      0.9286000    
 H   -1.803100      -3.865400     -0.6700000    
 H   -1.178800       4.569500     -0.3571000    
 H   -2.900600       4.183400     -0.5072000    
 H   -2.139400       4.253600       1.096900    
 H    3.296000       2.256000     -0.5523000    
 H    4.894500       1.407000       1.495100    
 H    4.104500      -1.204600       1.936600    


%chk=000003433-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003433

0 1
O 3.308419 -0.832274 0.203398
O 0.398633 -2.806581 -0.983236
O -3.598016 -1.237116 0.988326
N 0.136872 -0.484285 -0.778380
N -1.571282 -2.007880 0.008879
N -2.468378 1.600819 0.426582
N -0.434990 1.924440 -0.533931
C -0.685776 0.562231 -0.391059
C -1.934156 0.328051 0.198419
C 1.482200 -0.218773 -1.364499
C -0.297359 -1.822896 -0.606899
C -2.475222 -0.979488 0.453644
C -1.543886 2.534370 -0.024762
C 2.511059 0.195243 -0.356894
C -1.989752 -3.417887 0.184597
C -1.753278 4.014206 0.046983
C 2.894113 1.414546 0.180543
C 3.970600 1.155836 1.114019
C 4.192026 -0.211261 1.100722
H 1.361635 0.582011 -2.112436
H 1.790979 -1.153393 -1.860975
H -3.378009 1.779512 0.851733
H -2.971320 -3.408152 0.680742
H -1.249308 -3.956973 0.797431
H -2.056996 -3.918184 -0.795328
H -0.875603 4.516281 -0.386391
H -2.648762 4.330421 -0.519085
H -1.872721 4.361998 1.089654
H 2.434151 2.371278 -0.056894
H 4.507879 1.888418 1.713010
H 4.882047 -0.874115 1.615086


