%chk=000019228.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019228

0 1
 O  -0.7591000     -0.5329000     -0.7831000    
 O    1.547800      -1.716800     -0.7027000    
 N    2.761200      0.1094000      6.1500002E-02
 C    4.023900     -0.6187000      4.6200000E-02
 C    2.853800       1.502700      0.4905000    
 C    1.590600     -0.5394000     -0.3325000    
 C   0.3062000      0.2621000     -0.3082000    
 C    4.284100      -1.306100       1.370600    
 C    3.118700       2.427200     -0.6797000    
 C   -2.019800     -0.2329000     -0.3236000    
 C   -2.329400       1.076400      1.7600000E-02
 C   -2.963400      -1.244100     -0.2070000    
 C   -3.608100       1.380600      0.4847000    
 C   -4.242100     -0.9398000      0.2600000    
 C   -4.564400      0.3724000      0.6058000    
 H    3.991200      -1.375700     -0.7456000    
 H    4.841300      6.7699999E-02 -0.2004000    
 H    1.921900       1.801500      0.9779000    
 H    3.646100       1.598100       1.241300    
 H   0.1423000      0.5590000      0.7349000    
 H   0.4175000       1.138700     -0.9526000    
 H    4.343600     -0.5820000       2.189600    
 H    3.485300      -2.015200       1.611900    
 H    5.229100      -1.857100       1.334700    
 H    4.070800       2.188900      -1.164900    
 H    2.335400       2.353100      -1.440000    
 H    3.164400       3.466400     -0.3394000    
 H   -1.621300       1.892600     -8.6000003E-02
 H   -2.715400      -2.267000     -0.4751000    
 H   -3.861300       2.403200      0.7487000    
 H   -4.986900      -1.724700      0.3541000    
 H   -5.560500      0.6095000      0.9681000    


%chk=000019228-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000019228

0 1
O -0.759477 -0.774241 -0.171407
O 1.668718 -1.945218 -0.191452
N 2.820901 0.053332 0.120498
C 4.116372 -0.655068 -0.032880
C 2.867043 1.510679 0.377332
C 1.652705 -0.699351 0.023461
C 0.339484 0.091044 0.222989
C 4.666975 -1.175408 1.311831
C 2.943303 2.359819 -0.912641
C -2.061539 -0.263806 -0.020588
C -2.374969 1.028312 0.472026
C -3.095312 -1.153198 -0.407365
C -3.731925 1.418618 0.572413
C -4.439412 -0.748291 -0.301469
C -4.768103 0.540653 0.189134
H 3.952567 -1.503452 -0.718431
H 4.833441 0.041654 -0.506630
H 1.993305 1.813360 0.981460
H 3.754774 1.711859 1.006823
H 0.240073 0.381241 1.292370
H 0.337609 1.016531 -0.389568
H 4.815211 -0.353303 2.036561
H 3.967046 -1.907605 1.748600
H 5.640894 -1.675890 1.159474
H 3.832323 2.090552 -1.510234
H 2.052122 2.205074 -1.546586
H 3.010097 3.435241 -0.664643
H -1.590610 1.728725 0.774955
H -2.818213 -2.143672 -0.780587
H -3.972942 2.417752 0.953319
H -5.234084 -1.440475 -0.601424
H -5.814874 0.851635 0.269959


