%chk=000129556.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129556

0 1
 O   -1.703900     -0.7424000       1.036000    
 O  -0.4423000      0.5793000     -0.4782000    
 O   -4.667700       1.392600     -0.9285000    
 O   -4.396300      -1.410600      -1.391700    
 O   -3.318600       1.589800       1.497600    
 N    6.413400      -1.023400      -1.208200    
 C   -3.441800      0.6874000     -0.7475000    
 C   -3.745500     -0.7465000     -0.3112000    
 C   -2.577100       1.404000      0.2909000    
 C   -2.443700      -1.473800      5.3100001E-02
 C   -1.336200      0.5801000      0.6296000    
 C   -2.706800      -2.860500      0.6339000    
 C   0.8937000      0.4838000     -0.1920000    
 C    1.756800       1.499800     -0.5877000    
 C    1.374300     -0.6277000      0.4917000    
 C    3.606500      0.2911000      0.3891000    
 C    3.117500       1.403100     -0.2962000    
 C    2.735000     -0.7243000      0.7831000    
 C    5.061000      0.1878000      0.7010000    
 C    5.821800     -0.4895000     -0.3647000    
 H   -2.931100      0.6831000      -1.718400    
 H   -4.444000     -0.7335000      0.5344000    
 H   -2.306300       2.398600     -7.9899997E-02
 H   -1.820400      -1.606200     -0.8407000    
 H  -0.8501000       1.043000       1.499400    
 H   -3.330300      -2.795600       1.532400    
 H   -3.197600      -3.518700     -8.8399999E-02
 H   -1.764600      -3.328800      0.9396000    
 H   -5.196400      0.8958000      -1.576200    
 H   -4.731500      -2.260000      -1.059300    
 H   -3.435400      0.7234000       1.922400    
 H    1.379800       2.367500      -1.121500    
 H   0.7187000      -1.438800      0.7912000    
 H    3.785800       2.200700     -0.6099000    
 H    3.104200      -1.598500       1.313000    
 H    5.201300     -0.3471000       1.648700    
 H    5.477600       1.189000      0.8694000    


%chk=000129556-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129556

0 1
O -1.725366 -0.741061 1.160219
O -0.581825 1.016607 -0.082804
O -4.723773 1.392755 -0.908806
O -4.089706 -1.238347 -1.759114
O -3.714114 1.288711 1.851930
N 5.866278 -2.103332 -0.954261
C -3.448675 0.755607 -0.609161
C -3.605288 -0.768127 -0.448119
C -2.859172 1.391003 0.667597
C -2.247271 -1.412888 -0.075147
C -1.515200 0.701269 0.993087
C -2.326510 -2.900804 0.257596
C 0.792904 0.742696 0.111076
C 1.663192 1.324707 -0.839080
C 1.303331 -0.061813 1.157498
C 3.585807 0.312202 0.308243
C 3.050317 1.104946 -0.737981
C 2.698485 -0.263205 1.246953
C 5.093747 0.065003 0.403831
C 5.527158 -1.133074 -0.347756
H -2.722893 0.927315 -1.434264
H -4.357395 -0.990303 0.340660
H -2.721002 2.472048 0.513329
H -1.531483 -1.233258 -0.901421
H -1.126574 1.033942 1.972192
H -3.045676 -3.087672 1.075860
H -2.634436 -3.480727 -0.631376
H -1.338007 -3.272971 0.574874
H -5.106112 0.908607 -1.686794
H -4.488277 -2.138993 -1.668238
H -3.753830 0.335251 2.127450
H 1.241172 1.943260 -1.636763
H 0.630701 -0.550124 1.867169
H 3.719983 1.555978 -1.479632
H 3.093023 -0.891336 2.054645
H 5.400888 -0.064670 1.458562
H 5.655399 0.934798 0.014246


