%chk=000147823.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147823

0 1
 O   0.8025000      -2.450200     -0.4216000    
 O    1.296900       2.988900      0.3427000    
 O   -1.738400      -1.235300       2.252400    
 O    3.270600      -1.309100     -0.2667000    
 O   -4.911300      0.4288000     -0.8961000    
 N   -2.731600     -4.9000001E-03 -0.1571000    
 C   -1.632200     -0.9828000     -0.1181000    
 C  -0.2642000     -0.3230000     -4.7899999E-02
 C  -0.1269000       1.066700      0.1413000    
 C   -1.336700       1.963100      0.2221000    
 C   -2.582800       1.200900      0.6484000    
 C   0.8930000      -1.107600     -0.1859000    
 C   -1.850400      -1.959000       1.045000    
 C    1.153000       1.639500      0.1859000    
 C    2.290500      0.8442000      5.8899999E-02
 C    2.160600     -0.5283000     -0.1282000    
 C   -3.901100     -0.2649000     -0.8547000    
 C    3.649700       1.465600      0.1128000    
 C   0.7597000      -2.863600      -1.784200    
 C    1.341900       3.774500     -0.8448000    
 C    3.457200      -2.343700      0.6959000    
 H   -1.696700      -1.551400      -1.053000    
 H   -1.173300       2.781800      0.9320000    
 H   -1.503300       2.400000     -0.7702000    
 H   -2.536200      0.9247000       1.705100    
 H   -3.462300       1.843700      0.5317000    
 H   -1.124200      -2.775300       1.060000    
 H   -2.852400      -2.399700      0.9976000    
 H   -3.849900      -1.219700      -1.403500    
 H    3.664100       2.370700      0.7288000    
 H    4.383400      0.7882000      0.5632000    
 H    3.985800       1.721600     -0.8969000    
 H   -1.894100      -1.861600       2.979600    
 H   9.0599999E-02  -2.235300      -2.380400    
 H   0.3942000      -3.893600      -1.818000    
 H    1.766100      -2.837200      -2.212800    
 H    1.399800       4.827300     -0.5549000    
 H   0.4416000       3.630700      -1.449200    
 H    2.228300       3.529800      -1.437900    
 H    2.952100      -2.127100       1.643800    
 H    4.529800      -2.429000      0.8941000    
 H    3.112300      -3.299200      0.2911000    


%chk=000147823-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147823

0 1
O 0.589058 -2.513238 -0.518979
O 1.220672 3.020261 0.386678
O -1.739594 -1.184561 2.407308
O 3.235384 -1.359554 -0.393332
O -4.837199 0.663990 -1.147218
N -2.826296 -0.001754 -0.124492
C -1.746254 -1.001832 -0.041031
C -0.371827 -0.327084 -0.050855
C -0.222461 1.069065 0.148687
C -1.429706 1.979854 0.328267
C -2.695864 1.200117 0.730226
C 0.777517 -1.123179 -0.275456
C -1.919936 -1.957314 1.167999
C 1.084770 1.624093 0.137468
C 2.253918 0.835194 -0.017275
C 2.077956 -0.558002 -0.212425
C -3.878237 -0.148583 -1.006947
C 3.639997 1.440685 0.053316
C 1.078964 -2.976077 -1.841076
C 1.360928 3.841200 -0.829947
C 3.447149 -2.374861 0.666045
H -1.821500 -1.657794 -0.931860
H -1.198321 2.751047 1.084182
H -1.626065 2.519106 -0.620814
H -2.630055 0.870959 1.780728
H -3.604846 1.805879 0.582645
H -1.162503 -2.760211 1.081752
H -2.940146 -2.394098 1.125167
H -3.795459 -1.086975 -1.606199
H 3.611105 2.397139 0.600347
H 4.342464 0.751213 0.549556
H 4.051162 1.629385 -0.957152
H -1.763924 -1.797353 3.183048
H 0.533399 -2.458080 -2.652638
H 0.864470 -4.055473 -1.871645
H 2.162362 -2.789867 -1.942405
H 1.462176 4.880398 -0.480685
H 0.467058 3.748372 -1.477317
H 2.260279 3.550450 -1.407117
H 3.589581 -1.881154 1.645950
H 4.364560 -2.911059 0.378376
H 2.590961 -3.071099 0.719418


