%chk=000126247.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126247

0 1
 O    3.623900      0.4869000       1.741500    
 O   -5.037700     -2.5000000E-02  0.7140000    
 O   -4.115900      -1.633300     -0.6125000    
 N    2.429800      0.5979000     -0.2791000    
 N    3.677300      -2.175400     -0.1333000    
 C   2.0600000E-02  0.8401000     -0.4366000    
 C  -0.2148000     -0.2650000      0.6018000    
 C   -1.136200       1.848600     -0.4331000    
 C    1.351500       1.545300     -0.1812000    
 C   -2.712400      5.5700000E-02  0.3955000    
 C   -1.563200     -0.9523000      0.3973000    
 C   -2.484800       1.161100     -0.6359000    
 C    2.838700     -0.2503000      -1.377300    
 C    3.950700     -0.7796000     -0.4517000    
 C    3.375000      0.1883000      0.5958000    
 C   -4.002500     -0.6431000      9.4599999E-02
 H   4.9800001E-02  0.3725000      -1.430600    
 H  -0.1764000      0.1585000       1.613800    
 H   0.5674000      -1.029800      0.5488000    
 H  -0.9869000       2.591300      -1.225800    
 H   -1.150400       2.397000      0.5175000    
 H    1.377800       2.007500      0.8117000    
 H    1.530300       2.325500     -0.9288000    
 H   -2.779100      0.4933000       1.400500    
 H   -1.536300      -1.507100     -0.5498000    
 H   -1.718500      -1.697400       1.187300    
 H   -3.286600       1.907000     -0.5721000    
 H   -2.532000      0.7454000      -1.651200    
 H    3.193900      0.3205000      -2.240800    
 H    2.069400     -0.9589000      -1.698700    
 H    4.976400     -0.5579000     -0.7559000    
 H    3.878600      -2.815500     -0.9005000    
 H    2.715700      -2.367400      0.1461000    
 H   -5.893000     -0.4676000      0.5277000    


%chk=000126247-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126247

0 1
O 3.467579 0.162709 1.816862
O -5.267824 0.219973 0.861797
O -4.520351 -1.434258 -0.583142
N 2.425845 0.480571 -0.350031
N 4.349752 -2.207989 -0.482737
C -0.084179 0.752533 -0.442917
C -0.388048 -0.327567 0.622457
C -1.191082 1.836093 -0.440136
C 1.304910 1.406982 -0.229008
C -2.890046 0.134225 0.432122
C -1.786730 -0.953334 0.426917
C -2.594627 1.224382 -0.646653
C 2.983864 -0.260704 -1.519245
C 4.133943 -0.778890 -0.563724
C 3.358084 0.002508 0.579493
C -4.256461 -0.468974 0.168573
H -0.089160 0.265876 -1.443636
H -0.320272 0.133730 1.629814
H 0.384534 -1.119141 0.590000
H -0.996260 2.583849 -1.234719
H -1.165101 2.381415 0.526855
H 1.360969 1.840917 0.788689
H 1.434019 2.237722 -0.954566
H -2.923847 0.632279 1.420135
H -1.833622 -1.502208 -0.533418
H -1.984799 -1.693500 1.225192
H -3.367402 2.014211 -0.600735
H -2.654143 0.757973 -1.650316
H 3.300811 0.386255 -2.356881
H 2.336543 -1.074057 -1.892671
H 5.094757 -0.281593 -0.781018
H 5.256448 -2.498352 -0.114036
H 3.572368 -2.754459 -0.103977
H -6.150372 -0.182382 0.633658


