%chk=000125419.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125419

0 1
 O   -1.146200      -2.217500       1.377900    
 O   -3.486700      -1.448300      0.2959000    
 O   -3.819100       2.386600      0.1126000    
 O    1.878100      -1.979400      -1.363200    
 N   0.9066000     -0.2190000     -0.1672000    
 N    4.761600       1.280200      0.5037000    
 C  -0.4396000     -0.6846000     -0.3652000    
 C   -1.192200     -0.8641000      0.9595000    
 C   -2.627700     -0.3881000      0.6861000    
 C   -2.443800      0.5317000     -0.4823000    
 C   -1.244500      0.3677000      -1.056000    
 C   -3.520900       1.457800     -0.9193000    
 C    1.985900     -0.9430000     -0.7096000    
 C    1.137500      0.9451000      0.5596000    
 C    3.351600     -0.3893000     -0.4577000    
 C    2.367200       1.424800      0.7750000    
 C    3.532200      0.7395000      0.2501000    
 H  -0.4485000      -1.606600     -0.9575000    
 H  -0.7699000     -0.2670000       1.775400    
 H   -3.041900      0.1108000       1.568100    
 H  -0.9136000      0.9007000      -1.937200    
 H   -4.430200      0.8983000      -1.161200    
 H   -3.221500       2.021600      -1.809100    
 H   -1.725800      -2.302300       2.154000    
 H   0.2782000       1.481000      0.9474000    
 H   -4.384800      -1.085200      0.2112000    
 H    4.188900     -0.9414000     -0.8729000    
 H    2.504000       2.340100       1.341900    
 H   -4.531700       2.960600     -0.2164000    
 H    5.594900      0.8261000      0.1506000    
 H    4.841900       2.133600       1.042500    


%chk=000125419-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125419

0 1
O -1.219801 -1.933237 1.738248
O -3.494599 -1.194407 0.741867
O -4.797270 0.635599 -0.870647
O 1.591587 -2.054727 -1.209736
N 0.991733 -0.066242 -0.086982
N 5.041259 1.005302 0.327530
C -0.434896 -0.464135 -0.188403
C -1.172332 -0.594425 1.199387
C -2.608832 -0.023682 0.944714
C -2.475798 0.774169 -0.341477
C -1.291237 0.521035 -0.959527
C -3.637120 1.576025 -0.850376
C 1.983753 -0.988518 -0.629966
C 1.354566 1.124369 0.505450
C 3.353514 -0.575588 -0.453451
C 2.673132 1.509434 0.652221
C 3.714242 0.628840 0.168911
H -0.400036 -1.449421 -0.697470
H -0.644064 0.020814 1.950431
H -2.994108 0.565563 1.800331
H -0.980131 0.918667 -1.931738
H -3.444319 1.971223 -1.866475
H -3.867633 2.420325 -0.165642
H -2.059132 -2.340625 1.379058
H 0.535127 1.764101 0.849267
H -4.235287 -0.887969 0.144336
H 4.109990 -1.264257 -0.841336
H 2.911514 2.464767 1.127279
H -5.643353 1.131208 -0.997329
H 5.792889 0.401815 0.005632
H 5.286643 1.874381 0.792595


