%chk=000027216.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027216

0 1
 O  -0.5033000      0.5652000      8.2000000E-03
 O   -2.777600       2.162800     -4.0000002E-03
 N   -5.552800      -1.767400     -1.2700000E-02
 C    4.412300      0.4194000      4.3900002E-02
 C    3.126200     -0.4093000      1.8800000E-02
 C    5.685300     -0.4320000      4.2700000E-02
 C    1.890000      0.4886000     -2.7000001E-03
 C    6.970200      0.3955000     -6.6999998E-03
 C   0.6039000     -0.3254000      1.4500000E-02
 C    8.200900     -0.4958000     -7.8599997E-02
 C   -1.751900     -3.9999999E-04  4.0000002E-03
 C   -2.885600      0.8047000     -3.8000001E-03
 C   -1.867700      -1.386400      5.9000002E-03
 C   -4.150600      0.2171000     -9.7000003E-03
 C   -4.274200      -1.172300     -7.6000001E-03
 C   -3.132700      -1.974000      1.9999999E-04
 C   -3.992500       2.909700     -1.2400000E-02
 H    4.413900       1.063700      0.9318000    
 H    4.427200       1.084000     -0.8291000    
 H    3.125000      -1.059300     -0.8644000    
 H    3.096600      -1.060800      0.9005000    
 H    5.659400      -1.106400     -0.8225000    
 H    5.694700      -1.066700      0.9375000    
 H    1.899600       1.167900      0.8591000    
 H    1.902800       1.132300     -0.8911000    
 H    7.033900       1.034400      0.8815000    
 H    6.953700       1.055600     -0.8816000    
 H   0.5964000     -0.9379000      0.9249000    
 H   0.5928000     -0.9594000     -0.8812000    
 H    8.180800      -1.121500     -0.9766000    
 H    9.108900      0.1145000     -0.1102000    
 H    8.262000      -1.151100      0.7961000    
 H   -1.029400      -2.073700      1.3500000E-02
 H   -5.073200      0.7884000     -1.5500000E-02
 H   -3.217100      -3.057900      2.3000001E-03
 H   -6.381900      -1.188300     -1.9300001E-02
 H   -5.641900      -2.774900     -1.2100000E-02
 H   -3.718400       3.969900     -1.2200000E-02
 H   -4.570000       2.731700     -0.9260000    
 H   -4.580800       2.734300      0.8947000    


%chk=000027216-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027216

0 1
O -0.542970 0.414966 0.001198
O -2.623664 2.070861 -0.002648
N -5.803865 -1.701737 0.008411
C 4.442604 0.444323 -0.008324
C 3.171375 -0.434542 -0.006425
C 5.752206 -0.375734 -0.008574
C 1.868965 0.397575 -0.005426
C 7.023421 0.503972 -0.009565
C 0.617828 -0.484387 -0.000204
C 8.328134 -0.321817 -0.008746
C -1.816267 -0.186783 0.002936
C -2.936611 0.703410 0.001041
C -2.062139 -1.575007 0.006696
C -4.251313 0.192944 0.002932
C -4.489290 -1.212717 0.006662
C -3.378505 -2.090896 0.008507
C -3.739694 3.013450 -0.005208
H 4.427237 1.111085 0.878883
H 4.425699 1.109552 -0.896607
H 3.187994 -1.100520 -0.894757
H 3.190043 -1.099690 0.882530
H 5.769035 -1.042646 -0.896103
H 5.769749 -1.041410 0.879929
H 1.841212 1.059095 0.881509
H 1.836941 1.054574 -0.895557
H 7.004856 1.170410 0.876942
H 7.004883 1.168679 -0.897353
H 0.595840 -1.133857 0.902377
H 0.590517 -1.137530 -0.899943
H 8.385045 -0.972758 -0.901708
H 9.221364 0.329706 -0.007623
H 8.383343 -0.973323 0.883928
H -1.223762 -2.277614 0.008285
H -5.105448 0.878210 0.001506
H -3.536525 -3.175502 0.011340
H -6.597490 -1.069617 0.006504
H -5.982742 -2.700601 0.010485
H -3.272153 4.009036 -0.008529
H -4.370817 2.894937 -0.908964
H -4.370137 2.900705 0.899762


