%chk=000164043.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164043

0 1
 O   -5.043300     -0.2977000      -2.449800    
 N   -1.183100     -0.5578000      9.0599999E-02
 N   -3.188100     -0.7010000       1.166200    
 N   -3.083700     -0.4209000      -1.235900    
 N   -6.486300     -0.6143000      0.1741000    
 N   -5.414400     -0.8311000       2.124200    
 C    1.995400      0.5478000     -0.1813000    
 C    3.331500      0.2146000      0.1878000    
 C    1.157400     -0.5121000     -0.5835000    
 C    3.788000      -1.155800      0.1448000    
 C    1.538800       1.918100     -0.1384000    
 C    2.892700      -2.170900     -0.2691000    
 C    1.591300      -1.835200     -0.6271000    
 C  -0.2734000     -0.4207000      -1.015500    
 C    2.434200       2.933300      0.2756000    
 C    4.169500       1.274400      0.5899000    
 C    3.735600       2.597500      0.6336000    
 C    5.097500      -1.581300      0.4932000    
 C   0.2293000       2.343600     -0.4865000    
 C    3.297900      -3.516200     -0.3246000    
 C    2.029000       4.278600      0.3311000    
 C    5.491700      -2.921400      0.4349000    
 C    4.590400      -3.890200      2.5500000E-02
 C  -0.1650000       3.683800     -0.4281000    
 C   -2.524500     -0.5537000     -5.0600000E-02
 C   0.7363000       4.652500     -1.8700000E-02
 C   -4.530000     -0.7044000       1.095600    
 C   -5.153200     -0.5689000     -0.1186000    
 C   -4.469500     -0.4176000      -1.373700    
 C   -6.592200     -0.7729000       1.534400    
 H  -0.4751000      0.3481000      -1.766400    
 H  -0.4805000      -1.291700      -1.660100    
 H   0.9166000      -2.635500     -0.9312000    
 H    5.200800       1.100200      0.8859000    
 H    4.440300       3.362600      0.9548000    
 H    5.851500     -0.8710000      0.8224000    
 H  -0.6215000       1.734100     -0.6974000    
 H    2.603600      -4.291600     -0.6440000    
 H  -0.7850000     -0.6456000       1.021500    
 H    2.723700       5.052900      0.6520000    
 H    6.504300      -3.200600      0.7110000    
 H    4.889800      -4.932600     -2.2100000E-02
 H   -1.185100       3.963000     -0.6769000    
 H   0.4350000       5.694000      3.5300002E-02
 H   -2.669700     -0.7967000       2.033000    
 H   -7.252700     -0.5448000     -0.4824000    
 H   -7.552400     -0.8381000       2.026100    


%chk=000164043-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164043

0 1
O -4.937742 0.256971 -2.559847
N -1.238921 -0.744651 0.183044
N -3.394746 -0.819314 1.160596
N -3.079302 -0.261755 -1.185108
N -6.673672 -0.247718 -0.031067
N -5.754913 -0.826836 1.972561
C 1.979077 0.437855 -0.131819
C 3.390267 0.199118 0.070226
C 1.145465 -0.712212 -0.493645
C 3.938405 -1.156533 0.096108
C 1.480293 1.819678 -0.010148
C 3.066118 -2.265591 -0.184075
C 1.699882 -1.991182 -0.512456
C -0.305244 -0.646221 -0.965414
C 2.429993 2.908505 0.099648
C 4.286390 1.319100 0.218275
C 3.834526 2.622564 0.188462
C 5.308626 -1.451206 0.395292
C 0.092130 2.180660 0.052730
C 3.568553 -3.605190 -0.169552
C 1.983132 4.265481 0.161231
C 5.782805 -2.768463 0.414103
C 4.909827 -3.859595 0.126609
C -0.325751 3.515949 0.128655
C -2.602529 -0.601855 0.014901
C 0.621709 4.577288 0.158877
C -4.768731 -0.667416 1.008222
C -5.292092 -0.309750 -0.242487
C -4.468456 -0.075343 -1.428560
C -6.906326 -0.562465 1.298380
H -0.537102 0.267243 -1.535777
H -0.500635 -1.488200 -1.656231
H 1.067041 -2.835466 -0.815895
H 5.358600 1.137554 0.321435
H 4.539351 3.458989 0.260622
H 6.009434 -0.646248 0.631824
H -0.675346 1.410340 0.095411
H 2.881937 -4.429737 -0.395332
H -0.859687 -1.105480 1.059618
H 2.736126 5.059858 0.226895
H 6.833859 -2.963518 0.653704
H 5.292536 -4.885588 0.139887
H -1.397253 3.739390 0.172535
H 0.285165 5.618423 0.204863
H -3.006034 -1.058758 2.074292
H -7.355391 -0.010097 -0.751751
H -7.897976 -0.591778 1.741760


