%chk=000126858.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126858

0 1
 O   0.9833000      -2.414900      0.5269000    
 O   -1.636300      -1.247300      -1.310600    
 O   -2.833200      0.1602000      0.7371000    
 O    3.257400       1.229800      0.1809000    
 N   0.5356000       1.183600     -0.2284000    
 N   -1.515200       2.308800     -0.3424000    
 C   0.5028000      -1.300200     -0.2268000    
 C   -1.018000      -1.221800     -1.8700000E-02
 C    1.226600     -2.5900001E-02  0.2437000    
 C   -1.425500      6.0699999E-02  0.7083000    
 C  -0.7394000       1.234400      1.0400000E-02
 C    2.661700      3.2600001E-02 -0.2805000    
 H   0.7307000      -1.499500      -1.281400    
 H   -1.407900      -2.090300      0.5251000    
 H    1.283000      5.5999998E-03   1.340900    
 H   -1.071300      2.8700000E-02   1.745800    
 H    2.683100      3.7400000E-02  -1.375600    
 H    3.254300     -0.8122000      8.2800001E-02
 H    1.918300      -2.548100      0.2980000    
 H   -1.423400      -2.104000      -1.718700    
 H   -3.062500      0.9001000       1.324900    
 H   -2.513000       2.333800     -0.1632000    
 H   -1.109800       3.113400     -0.8084000    
 H    4.166700       1.249600     -0.1631000    


%chk=000126858-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126858

0 1
O 0.922411 -2.469980 0.877055
O -1.413618 -1.242158 -1.427158
O -2.784734 0.337918 0.431150
O 3.414330 1.227178 -0.161817
N 0.736983 1.160524 -0.191208
N -1.288393 2.363042 -0.348604
C 0.607032 -1.402143 -0.093812
C -0.924862 -1.232176 -0.046455
C 1.389057 -0.099083 0.256813
C -1.338808 0.099318 0.629580
C -0.559145 1.250436 -0.005087
C 2.801760 -0.075833 -0.380116
H 0.856364 -1.721109 -1.126787
H -1.348347 -2.084011 0.526468
H 1.502456 -0.082182 1.364587
H -1.092448 0.050857 1.711042
H 2.707470 -0.295030 -1.467565
H 3.472952 -0.823856 0.081749
H 1.894283 -2.656912 0.846370
H -2.334293 -0.866624 -1.417425
H -3.304773 -0.168966 1.102567
H -2.301299 2.333874 -0.249956
H -0.821211 3.144736 -0.802439
H 2.654834 1.866681 -0.301950


