%chk=000173117.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173117

0 1
 O    6.351300     -0.9966000      1.6000001E-02
 O    5.571000       1.133400     -7.2700001E-02
 N   -3.507000      0.3319000     -3.9500002E-02
 N   -5.397100     -0.5315000      0.7017000    
 C   0.3419000      0.6402000      6.8400003E-02
 C    1.470700     -0.3936000      5.8600001E-02
 C   -1.031100     -3.7599999E-02  5.4200001E-02
 C    2.843800      0.2853000      3.5399999E-02
 C   -2.190900      0.9590000     -1.6500000E-02
 C    3.993400     -0.7220000     -1.8000000E-03
 C   -4.186900     -4.5200001E-02  -1.152000    
 C   -4.258800      2.6600000E-02   1.049500    
 C    5.358200     -7.0299998E-02 -3.2000002E-02
 C   -5.358400     -0.5797000     -0.6693000    
 H   0.4277000       1.276900      0.9571000    
 H   0.4345000       1.292600     -0.8084000    
 H    1.392300      -1.034800      0.9448000    
 H    1.369700      -1.041200     -0.8207000    
 H   -1.139500     -0.6605000      0.9512000    
 H   -1.092400     -0.7194000     -0.8038000    
 H    2.950500      0.9280000      0.9183000    
 H    2.911700      0.9447000     -0.8392000    
 H   -2.114100       1.577300     -0.9189000    
 H   -2.171300       1.634900      0.8467000    
 H    3.902800      -1.351200     -0.8943000    
 H    3.944600      -1.361200      0.8871000    
 H   -3.803400      8.7499999E-02  -2.154000    
 H   -3.938900      0.2258000       2.063100    
 H   -6.175600     -0.9968000      -1.239500    
 H    7.239600     -0.5805000      7.1999999E-03


%chk=000173117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000173117

0 1
O 6.411198 -1.059995 0.006020
O 5.667038 1.138268 0.065100
N -3.544118 0.384097 0.002171
N -5.523550 -0.464363 0.729250
C 0.330936 0.644065 0.034238
C 1.492894 -0.373048 -0.021633
C -1.057549 -0.030004 -0.019402
C 2.880112 0.302807 0.032296
C -2.206432 1.002630 0.035142
C 4.027564 -0.723259 -0.015385
C -4.174785 -0.181078 -1.115189
C -4.396083 0.183322 1.087956
C 5.401371 -0.082726 0.023720
C -5.389301 -0.693737 -0.650384
H 0.416627 1.244580 0.963843
H 0.430604 1.359177 -0.809020
H 1.393294 -1.087665 0.821852
H 1.407469 -0.974078 -0.951035
H -1.167961 -0.737776 0.825361
H -1.147909 -0.627998 -0.947653
H 2.968549 0.908613 0.954524
H 2.987368 1.012845 -0.809978
H -2.118402 1.710505 -0.810925
H -2.134526 1.595939 0.965647
H 3.971236 -1.343800 -0.931774
H 3.962425 -1.437345 0.829033
H -3.726299 -0.160005 -2.105350
H -4.156070 0.526528 2.092132
H -6.167524 -1.202949 -1.214204
H 7.300124 -0.611550 0.030347


