%chk=000002314.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002314

0 1
 O  -0.7851000      -1.190500      0.4032000    
 O   -2.799600     -0.1218000     -0.3779000    
 O    1.651300      0.2653000      0.9400000    
 O    2.296600     -4.5800000E-02  -1.271900    
 N    3.642800     -0.7820000      0.4682000    
 C   -2.166100      -1.368200      2.0999999E-03
 C  -0.6316000      0.1541000      0.2510000    
 C   -1.781600      0.7643000     -0.1948000    
 C   -2.937500      -1.961600       1.180000    
 C   -2.201400      -2.312800      -1.198800    
 C   0.5207000      0.8704000      0.5004000    
 C   -1.843200       2.124500     -0.4160000    
 C   0.4854000       2.250000      0.2843000    
 C  -0.6898000       2.873500     -0.1712000    
 C    2.524700     -0.1820000     -7.3500000E-02
 C    4.714400      -1.337500     -0.3251000    
 H   -3.991300      -2.118500      0.9268000    
 H   -2.498400      -2.910400       1.505500    
 H   -2.909300      -1.280700       2.038600    
 H   -3.227500      -2.482600      -1.541300    
 H   -1.646200      -1.883100      -2.040700    
 H   -1.735100      -3.274800     -0.9619000    
 H   -2.751200       2.601300     -0.7674000    
 H    1.370100       2.854500      0.4681000    
 H  -0.6989000       3.947900     -0.3337000    
 H    3.716600     -0.8355000       1.479400    
 H    4.805600      -2.398400     -7.9800002E-02
 H    5.640100     -0.8235000     -5.5199999E-02
 H    4.522300      -1.219100      -1.394000    


%chk=000002314-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000002314

0 1
O -0.640719 -1.009438 0.533261
O -2.800317 -0.131177 -0.044723
O 1.843118 0.713284 0.685776
O 1.955520 -0.661747 -1.260216
N 3.550943 -0.760865 0.471684
C -2.023082 -1.426463 0.072163
C -0.562774 0.370233 0.268330
C -1.832453 0.899597 -0.051700
C -2.658815 -2.281858 1.155721
C -1.902658 -2.059394 -1.312923
C 0.560634 1.202756 0.330719
C -2.040240 2.262481 -0.281824
C 0.382603 2.589363 0.097662
C -0.898523 3.107282 -0.195195
C 2.418927 -0.305766 -0.155687
C 4.418108 -1.777581 -0.127431
H -3.685073 -2.559203 0.861229
H -2.069048 -3.202638 1.301183
H -2.696189 -1.724946 2.105259
H -2.905048 -2.298567 -1.707425
H -1.397535 -1.365968 -2.005659
H -1.305897 -2.985225 -1.252867
H -3.032441 2.654695 -0.517585
H 1.259916 3.240965 0.144552
H -1.014082 4.181118 -0.372505
H 3.768595 -0.364897 1.386297
H 4.477100 -2.679108 0.509869
H 5.439340 -1.387603 -0.293429
H 3.986891 -2.062332 -1.100135


