%chk=000032723.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032723

0 1
 O   -1.255300     -0.3295000       2.046300    
 O  -0.4549000      -2.242300     -0.3610000    
 N    3.578800      -1.014300      0.1273000    
 C    3.744000      0.4461000      0.1350000    
 C    4.589000      -1.658700     -0.7235000    
 C    5.131500      0.8418000      0.6428000    
 C    6.004000      -1.331700     -0.2440000    
 C    6.231900      0.1740000     -0.1738000    
 C    2.232000      -1.374500     -0.3154000    
 C    1.188700     -0.8061000      0.6435000    
 C   -1.374700     -0.2159000      0.6127000    
 C  -0.2366000      -1.181000      0.2282000    
 C   -2.766700     -0.6702000      0.1573000    
 C   -1.121100       1.229800      0.1891000    
 C   -3.053400     -0.6572000      -1.186900    
 C   -1.479600       2.243700       1.049400    
 C   -3.670500      -1.071200       1.111900    
 C  -0.5436000       1.467600      -1.038200    
 C   -4.319700      -1.070000      -1.601300    
 C   -1.248500       3.563800      0.6624000    
 C   -4.936700      -1.484100      0.6976000    
 C  -0.3123000       2.787700      -1.425300    
 C   -5.261300      -1.483400     -0.6590000    
 C  -0.6649000       3.835700     -0.5749000    
 H    3.050700      0.9396000      0.8200000    
 H    3.580800      0.8671000     -0.8657000    
 H    4.474200      -1.347400      -1.770200    
 H    4.462400      -2.747700     -0.6919000    
 H    5.234000      0.5545000       1.697200    
 H    5.247300       1.930600      0.5956000    
 H    6.737900      -1.785300     -0.9197000    
 H    6.166900      -1.772600      0.7477000    
 H    6.239000      0.5909000      -1.188400    
 H    7.211100      0.3863000      0.2691000    
 H    2.036100      -1.022700      -1.337100    
 H    2.134200      -2.467400     -0.3319000    
 H    1.233900      0.2799000      0.6928000    
 H    1.346800      -1.194600       1.656600    
 H  -0.5165000      0.2223000       2.355100    
 H   -2.334900     -0.3667000      -1.943600    
 H   -1.950300       2.056800       2.009300    
 H   -3.454700      -1.083700       2.174400    
 H  -0.2556000      0.6698000      -1.715100    
 H   -4.570700      -1.075400      -2.658000    
 H   -1.526500       4.380100       1.322600    
 H   -5.670500      -1.806100       1.430800    
 H   0.1435000       2.999500      -2.388100    
 H   -6.246800      -1.806300     -0.9817000    
 H  -0.4854000       4.863500     -0.8766000    


%chk=000032723-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000032723

0 1
O -0.589874 1.454580 1.574084
O 0.150259 0.785092 -1.919470
N 3.523705 -1.153093 -0.069564
C 4.487350 -0.158067 0.467605
C 4.216602 -2.196445 -0.872138
C 5.566199 -0.832411 1.340844
C 5.278769 -2.934292 -0.033583
C 6.302947 -1.934573 0.548101
C 2.418483 -0.524024 -0.834649
C 1.414697 0.194629 0.085574
C -1.051038 1.095388 0.205806
C 0.200367 0.715757 -0.662664
C -1.860133 -0.210934 0.321525
C -1.857303 2.273703 -0.361462
C -2.435707 -0.780256 -0.843783
C -3.239761 2.388310 -0.064580
C -2.014094 -0.863074 1.567308
C -1.218617 3.330126 -1.062473
C -3.170068 -1.981565 -0.757575
C -3.968580 3.530363 -0.459833
C -2.751103 -2.067091 1.649723
C -1.947797 4.473242 -1.457860
C -3.331557 -2.629896 0.490432
C -3.325063 4.578489 -1.157851
H 3.934730 0.584565 1.071988
H 4.988381 0.402175 -0.368596
H 4.712803 -1.749221 -1.775673
H 3.455122 -2.911281 -1.236177
H 5.077409 -1.279573 2.228048
H 6.278411 -0.064589 1.700223
H 5.783475 -3.691343 -0.664343
H 4.771869 -3.468136 0.793534
H 6.876119 -1.470596 -0.281656
H 7.033753 -2.456221 1.194739
H 2.793853 0.185698 -1.612776
H 1.879703 -1.322223 -1.378233
H 1.881025 1.051676 0.612258
H 1.082929 -0.481256 0.896022
H -0.535452 2.442487 1.622877
H -2.301564 -0.281873 -1.810695
H -3.742114 1.578825 0.475562
H -1.566077 -0.412332 2.456804
H -0.159547 3.252311 -1.327544
H -3.614074 -2.412349 -1.661964
H -5.036129 3.602592 -0.224071
H -2.870637 -2.563980 2.619238
H -1.443345 5.275824 -2.007247
H -3.901250 -3.563760 0.556396
H -3.891074 5.463724 -1.468831


