%chk=000077606.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077606

0 1
 O    2.417300      -2.991000      0.5453000    
 O    2.781900       2.640600      0.9601000    
 O    1.756100      -2.317600      -1.521500    
 O    2.325700       2.187800      -1.219100    
 N   0.8589000     -1.0600000E-02  4.8200000E-02
 C  -0.1106000      0.8527000      0.7214000    
 C   -1.526800      0.5037000      0.3481000    
 C   0.6350000      -1.409800      0.4097000    
 C    2.223500      0.3926000      0.3861000    
 C   -2.117900       1.123300     -0.7442000    
 C   -2.221400     -0.4324000       1.101400    
 C    1.650800      -2.259300     -0.3029000    
 C    2.428700       1.814600     -5.7399999E-02
 C   -3.429900      0.8001000      -1.090100    
 C   -3.533500     -0.7555000      0.7553000    
 C   -4.137800     -0.1393000     -0.3404000    
 H   3.3199999E-02   1.909300      0.4631000    
 H   1.7000000E-03  0.8019000       1.814100    
 H  -0.3262000      -1.802800      6.5800004E-02
 H   0.7102000      -1.574100       1.491900    
 H    2.993800     -0.1894000     -0.1320000    
 H    2.416300      0.3076000       1.463200    
 H   -1.575200       1.854600      -1.336700    
 H   -1.770100     -0.9103000       1.966300    
 H   -3.900400       1.279600      -1.943700    
 H   -4.085800      -1.484600       1.341000    
 H   -5.159600     -0.3905000     -0.6095000    
 H    3.062300      -3.551800      6.3900001E-02
 H    2.928300       3.560000      0.6509000    


%chk=000077606-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077606

0 1
O 1.562179 -3.462792 -0.465890
O 3.501925 2.694566 0.249656
O 2.468956 -1.544862 -1.410478
O 1.359254 2.694487 -0.647970
N 0.908050 0.065094 0.465413
C -0.218553 0.673089 1.219433
C -1.572861 0.333661 0.607092
C 0.936385 -1.395910 0.557491
C 2.200543 0.728667 0.646810
C -1.791454 0.559857 -0.776542
C -2.629222 -0.176496 1.399430
C 1.736874 -2.072763 -0.548466
C 2.247431 2.111400 0.004635
C -3.048326 0.279546 -1.353858
C -3.891182 -0.455344 0.822389
C -4.103069 -0.228004 -0.556036
H -0.075189 1.767723 1.181095
H -0.207354 0.374744 2.297555
H -0.100253 -1.771650 0.481381
H 1.331071 -1.788228 1.530589
H 2.988170 0.136946 0.148248
H 2.512471 0.847674 1.714697
H -0.963274 0.948931 -1.379070
H -2.466630 -0.355895 2.470146
H -3.209850 0.459552 -2.422877
H -4.701971 -0.851012 1.444697
H -5.078823 -0.444650 -1.005688
H 2.093542 -3.904246 -1.182712
H 3.539662 3.585316 -0.192869


