%chk=000087736.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000087736

0 1
 O    2.341000     -0.5941000      4.4000000E-02
 O   0.3782000      -2.520900     -0.2764000    
 O    1.626200       2.077400      0.2097000    
 N   -3.735900      0.9507000       1.038300    
 C   -1.654400      0.5157000     -0.1900000    
 C    1.029300     -0.2295000     -3.1700000E-02
 C   4.3400001E-02  -1.203000     -0.1934000    
 C   0.6733000       1.116700      5.0900001E-02
 C   -1.298400     -0.8304000     -0.2726000    
 C  -0.6686000       1.489300     -2.8200001E-02
 C   -3.089100      0.9136000     -0.2745000    
 C    2.861100     -0.8730000       1.341900    
 C  -0.6898000      -3.451800     -0.4412000    
 C    2.183700       2.639400     -0.9766000    
 H   -2.107800      -1.542200     -0.3961000    
 H  -0.9406000       2.540000      3.9200000E-02
 H   -3.639600      0.2234000     -0.9248000    
 H   -3.182200       1.899400     -0.7453000    
 H   -3.671700      3.5100002E-02   1.481400    
 H   -3.244600       1.603600       1.647500    
 H    2.324400      -1.709300       1.800800    
 H    2.794400      1.2300000E-02   1.982000    
 H    3.913800      -1.149100       1.236800    
 H   -1.365600      -3.447900      0.4208000    
 H   -1.218500      -3.296800      -1.387900    
 H  -0.2420000      -4.450000     -0.4882000    
 H    1.407400       3.136900      -1.566500    
 H    2.931400       3.382100     -0.6852000    
 H    2.673900       1.866000      -1.576300    


%chk=000087736-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000087736

0 1
O 2.350496 -0.282646 -0.011069
O 0.523310 -2.376698 -0.213575
O 1.388902 2.415950 0.075870
N -3.927673 1.069990 1.152925
C -1.824290 0.578105 -0.198123
C 0.964939 -0.027369 -0.059823
C -0.002652 -1.071710 -0.171573
C 0.514610 1.322061 -0.062859
C -1.382652 -0.768828 -0.232276
C -0.867773 1.614204 -0.132787
C -3.322432 0.898855 -0.193729
C 2.822095 -1.074477 1.145923
C -0.423723 -3.479937 -0.389420
C 2.494048 2.523915 -0.901628
H -2.123463 -1.571092 -0.317625
H -1.168928 2.667492 -0.129929
H -3.879173 0.095237 -0.711079
H -3.507641 1.830583 -0.758933
H -3.858246 0.225443 1.732996
H -3.556536 1.883954 1.657006
H 2.398126 -2.092235 1.115892
H 2.549728 -0.571297 2.093256
H 3.917424 -1.111423 1.041228
H -1.132623 -3.544839 0.459172
H -0.987674 -3.375936 -1.336342
H 0.197065 -4.387319 -0.425046
H 2.085462 2.661129 -1.921877
H 3.054177 3.422457 -0.600253
H 3.137795 1.630029 -0.867924


