%chk=000048549.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048549

0 1
 O   0.5103000     -0.4753000       2.259200    
 O   0.1954000      0.7828000      -2.367700    
 O   -3.526300     -0.2346000      0.1042000    
 N   -1.487600     -0.3412000       1.153500    
 N   -1.641200      0.2699000      -1.104200    
 C   0.5852000      0.2134000     -5.3500000E-02
 C    1.663200     -0.8185000     -0.4116000    
 C    1.204000       1.544000      0.2715000    
 C  -0.1096000     -0.2347000       1.221100    
 C  -0.2800000      0.4447000      -1.281600    
 C   0.2581000       2.626800      0.6988000    
 C    1.052300      -2.151100     -0.7011000    
 C   -2.301400     -0.1091000      5.5000000E-02
 C    2.526400       1.751100      0.1850000    
 C    1.351200      -3.268000     -2.8500000E-02
 H    2.393400     -0.9370000      0.4013000    
 H    2.220500     -0.5308000      -1.313800    
 H   -1.958000     -0.6282000       2.007500    
 H   -2.225100      0.4352000      -1.919400    
 H  -0.4938000       2.830300     -6.9700003E-02
 H  -0.2537000       2.371200       1.631500    
 H   0.7858000       3.570600      0.8787000    
 H   0.3503000      -2.226600      -1.527500    
 H    2.935200       2.728100      0.4300000    
 H    3.262600       1.020300     -0.1204000    
 H   0.8866000      -4.210700     -0.2965000    
 H    2.055900      -3.265200      0.7956000    


%chk=000048549-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048549

0 1
O 0.565647 -0.545662 2.284052
O 0.149758 0.707349 -2.413567
O -3.564015 -0.319648 0.175125
N -1.464602 -0.388200 1.199649
N -1.666863 0.232460 -1.072065
C 0.642758 0.233568 -0.048766
C 1.720278 -0.848024 -0.429816
C 1.259089 1.624831 0.271958
C -0.063457 -0.265734 1.234265
C -0.286428 0.411820 -1.272992
C 0.263605 2.702253 0.669189
C 1.112430 -2.186300 -0.801598
C -2.319779 -0.168866 0.107539
C 2.590774 1.864754 0.207881
C 1.185652 -3.303010 -0.035003
H 2.396205 -0.957747 0.434779
H 2.287470 -0.444813 -1.288385
H -1.919758 -0.713086 2.059395
H -2.274484 0.371534 -1.886701
H -0.485401 2.882685 -0.126213
H -0.290494 2.426780 1.587563
H 0.778037 3.657183 0.864622
H 0.597451 -2.232644 -1.773612
H 2.986258 2.859569 0.441615
H 3.325503 1.105054 -0.070303
H 0.737870 -4.249831 -0.357158
H 1.696198 -3.298875 0.935944


