%chk=000131820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131820

0 1
 O    1.665100       2.148100     -0.6508000    
 O   -3.508900       1.052200      0.9133000    
 O    4.037700      -1.005700       1.717700    
 O    6.035700     -0.9427000      -1.250500    
 N    4.415000      -1.068400      0.3726000    
 N    6.615400     -0.6435000      0.9362000    
 C    2.231400     -0.2909000     -0.4070000    
 C   1.7700000E-02  0.5094000      7.1199998E-02
 C    2.634300       1.102200     -0.8110000    
 C   0.9913000     -0.5693000      1.1600000E-02
 C   0.4005000       1.809900     -0.2625000    
 C    3.292000      -1.346200     -0.5075000    
 C   -1.301800      0.2593000      0.4673000    
 C  -0.5273000       2.853100     -0.1974000    
 C   -2.227600       1.301900      0.5281000    
 C   -1.840200       2.598300      0.1964000    
 C   -4.142000     -5.1300000E-02  0.3663000    
 C    5.698500     -0.8883000     -6.6200003E-02
 C   -4.034300     -0.2851000     -0.9927000    
 C   -4.866500     -0.8908000       1.193000    
 C   -4.672900      -1.396000      -1.543700    
 C   -5.505000      -2.001800      0.6420000    
 C   -5.408200      -2.254300     -0.7264000    
 H    3.510600       1.416200     -0.2335000    
 H    2.926400       1.099800      -1.867600    
 H   0.6918000      -1.570300      0.3010000    
 H    3.635800      -1.421600      -1.545000    
 H    2.903700      -2.332700     -0.2269000    
 H   -1.587800     -0.7520000      0.7499000    
 H  -0.2332000       3.867800     -0.4532000    
 H   -2.556000       3.414300      0.2429000    
 H   -3.487800      0.3809000      -1.654000    
 H   -4.942600     -0.6954000       2.258400    
 H    4.084200      -1.946400       1.959400    
 H   -4.602100      -1.589900      -2.610100    
 H   -6.077700      -2.670100       1.278400    
 H   -5.906500      -3.118600      -1.155800    
 H    7.597500     -0.4973000      0.7287000    
 H    6.334300     -0.6004000       1.910000    


%chk=000131820-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131820

0 1
O 1.967951 1.976087 -0.487275
O -3.367459 0.882039 0.934998
O 4.197722 -1.457706 1.710567
O 6.041872 -0.048877 -1.051249
N 4.677743 -1.364934 0.318139
N 6.299159 0.059485 1.280506
C 2.492776 -0.476858 -0.604375
C 0.229722 0.291941 -0.005907
C 2.769464 0.914631 -1.153385
C 1.255617 -0.752522 -0.098583
C 0.632188 1.649046 -0.199102
C 3.594429 -1.514686 -0.693166
C -1.115742 0.023610 0.344962
C -0.278295 2.708284 -0.013885
C -2.031845 1.086440 0.491859
C -1.619358 2.426733 0.325512
C -4.176905 -0.130657 0.364669
C 5.704264 -0.395483 0.122757
C -3.984748 -0.645337 -0.939647
C -5.265052 -0.556173 1.160608
C -4.895268 -1.604633 -1.438153
C -6.166539 -1.512099 0.646575
C -5.985670 -2.044618 -0.652606
H 3.816891 1.221598 -1.011354
H 2.547596 0.948969 -2.243508
H 1.014709 -1.756359 0.272401
H 4.120514 -1.461122 -1.664125
H 3.174528 -2.530019 -0.582145
H -1.437560 -1.009396 0.518020
H 0.069067 3.737396 -0.142321
H -2.348792 3.229268 0.466946
H -3.151605 -0.296703 -1.557470
H -5.386604 -0.130249 2.161108
H 4.381494 -2.404447 1.959208
H -4.752364 -2.001160 -2.449735
H -7.010331 -1.842169 1.262697
H -6.686604 -2.787434 -1.047677
H 7.072113 0.712861 1.189046
H 5.891422 -0.160349 2.187691


