%chk=000129632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129632

0 1
 O    1.978000      -3.086600     -0.7293000    
 O  -0.3228000      -1.524200     -0.3241000    
 O   -4.799900       1.421100      0.9750000    
 N    2.523600      0.1722000      0.9442000    
 N  -0.6266000      0.7582000      -3.078400    
 C    3.092700       1.422800      0.4755000    
 C    2.508000     -0.8288000     -0.1164000    
 C    1.895000      -2.151300      0.3498000    
 C    4.535700       1.182400      1.6899999E-02
 C    2.256000       1.945500     -0.6969000    
 C    3.080500       2.444800       1.618100    
 C   0.4337000      -2.023200      0.7747000    
 C   -1.432000     -0.7812000     -2.0400001E-02
 C   -1.875100      0.2277000     -0.8710000    
 C   -2.113100      -1.054500       1.162800    
 C   -3.008200      0.9691000     -0.5361000    
 C   -3.246300     -0.3133000       1.497600    
 C   -3.693700      0.6985000      0.6483000    
 C   -1.185400      0.5207000      -2.090200    
 H    3.051000     -0.1826000       1.741500    
 H    1.947800     -0.5102000      -1.000600    
 H    3.517900      -1.073600     -0.4633000    
 H    2.483600      -2.560300       1.179800    
 H    5.117700      0.6407000      0.7722000    
 H    5.045200       2.140400     -0.1472000    
 H    4.609600      0.6406000     -0.9318000    
 H    1.185500       1.945800     -0.4604000    
 H    2.408600       1.393300      -1.629900    
 H    2.528200       2.984700     -0.9215000    
 H    2.060300       2.630700       1.974000    
 H    3.498300       3.405900       1.297200    
 H    3.673100       2.096600       2.472300    
 H   0.3846000      -1.364700       1.650800    
 H   4.1000001E-02  -3.012200       1.039000    
 H    1.619500      -3.932900     -0.4116000    
 H   -1.823300      -1.853300       1.838400    
 H   -3.360000       1.759200      -1.196400    
 H   -3.780900     -0.5331000       2.417700    
 H   -4.965900       2.077400      0.2766000    


%chk=000129632-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129632

0 1
O 1.631188 -3.142835 -0.645888
O -0.245115 -1.113484 -0.196417
O -5.394794 1.088663 0.381670
N 3.089120 -0.070829 1.003301
N -0.993762 -0.264112 -3.509516
C 3.440564 1.357257 0.693778
C 2.715699 -0.964465 -0.116589
C 1.839551 -2.133921 0.399650
C 4.563266 1.472993 -0.379882
C 2.172066 2.106271 0.213883
C 3.927254 1.981441 2.024252
C 0.502447 -1.645113 0.968834
C -1.514883 -0.580335 0.003529
C -2.180729 -0.102671 -1.165429
C -2.161917 -0.485367 1.260135
C -3.481110 0.459791 -1.061270
C -3.450500 0.073143 1.354912
C -4.111769 0.545747 0.197247
C -1.530329 -0.192715 -2.442408
H 3.831115 -0.496374 1.578793
H 2.130328 -0.391460 -0.856875
H 3.580806 -1.411310 -0.653840
H 2.377385 -2.672766 1.201978
H 5.488298 0.971326 -0.036795
H 4.804692 2.532356 -0.586842
H 4.251720 1.006612 -1.332332
H 1.368080 2.012862 0.965473
H 1.793092 1.711865 -0.746367
H 2.395759 3.178514 0.066061
H 3.138397 1.909144 2.793948
H 4.186917 3.045574 1.883416
H 4.829786 1.461177 2.401522
H 0.686775 -0.838797 1.703754
H -0.069289 -2.481468 1.414471
H 1.019045 -2.751494 -1.322854
H -1.667021 -0.843410 2.166201
H -3.975930 0.820487 -1.970449
H -3.959523 0.150655 2.319820
H -5.784778 1.389348 -0.475974


