%chk=000073887.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073887

0 1
 O    3.007700      0.2145000     -0.3614000    
 O   -2.965700     -0.1695000      0.3576000    
 O    4.600200     -0.1623000       1.269300    
 O   -4.647700      0.1510000      -1.193200    
 N   0.1314000      0.3274000     -0.5115000    
 N  -0.1591000     -0.3807000      0.4693000    
 C   0.9476000       1.484200     -0.1103000    
 C  -0.9695000      -1.530500      7.0900001E-02
 C    2.228000      0.9686000      0.5591000    
 C   -2.273100      -1.015500     -0.5527000    
 C   0.1257000       2.301300      0.8885000    
 C    1.243300       2.313600      -1.361900    
 C   -1.275000      -2.336500       1.335000    
 C  -0.1509000      -2.370700     -0.9118000    
 C    4.177000     -0.2964000      0.1290000    
 C   -4.146900      0.3493000     -9.4499998E-02
 C    4.888000      -1.062400     -0.9452000    
 C   -4.761000       1.214600      0.9638000    
 H    2.825600       1.825400      0.8978000    
 H    2.009100      0.3510000       1.439300    
 H   -2.076600     -0.4601000      -1.478800    
 H   -2.917400      -1.867000     -0.8078000    
 H   0.6449000       3.230300       1.150800    
 H  -0.8509000       2.572700      0.4703000    
 H  -5.8300000E-02   1.761200       1.824300    
 H    1.758200       1.719200      -2.124900    
 H    1.871000       3.179100      -1.124300    
 H   0.3165000       2.682200      -1.816500    
 H   -1.908200      -3.202000       1.111500    
 H  -0.3516000      -2.706400       1.796200    
 H   -1.784700      -1.728600       2.091100    
 H   3.7900001E-02  -1.842900      -1.853500    
 H  -0.6785000      -3.298000      -1.162400    
 H   0.8225000      -2.643300     -0.4872000    
 H    5.127600     -0.3965000      -1.778000    
 H    4.262600      -1.892600      -1.283100    
 H    5.820800      -1.469300     -0.5442000    
 H   -4.085800       2.039500       1.204800    
 H   -4.972200      0.6170000       1.854100    
 H   -5.701300       1.631200      0.5917000    


%chk=000073887-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073887

0 1
O 2.910259 0.561176 -0.295756
O -2.901957 -0.555098 0.297936
O 3.667552 -0.858641 1.402000
O -3.673898 0.858353 -1.398354
N -0.189279 0.565323 -0.241906
N 0.196264 -0.558632 0.237734
C 0.758676 1.727071 0.016598
C -0.751728 -1.720457 -0.020894
C 2.088792 1.323014 0.679294
C -2.082977 -1.315421 -0.680461
C -0.015871 2.664039 0.980664
C 0.957751 2.405691 -1.358617
C -0.947883 -2.401367 1.353562
C 0.021452 -2.655549 -0.987896
C 3.620290 -0.543206 0.193524
C -3.619475 0.545090 -0.189558
C 4.292789 -1.271286 -0.951181
C -4.289315 1.272433 0.957169
H 2.660963 2.225992 0.960070
H 1.924190 0.691428 1.569127
H -1.919882 -0.682123 -1.569343
H -2.655916 -2.217636 -0.962139
H 0.525504 3.619234 1.102286
H -1.014952 2.881332 0.564798
H -0.144091 2.198629 1.974960
H 1.531846 1.752722 -2.035851
H 1.510738 3.354706 -1.237919
H -0.023670 2.619930 -1.815107
H -1.500585 -3.350498 1.232414
H 0.034530 -2.615691 1.807857
H -1.521010 -1.749795 2.032946
H 0.147651 -2.188532 -1.981695
H -0.519763 -3.610773 -1.109985
H 1.021357 -2.873149 -0.574168
H 4.808882 -0.558195 -1.614964
H 3.529348 -1.793520 -1.556006
H 5.006636 -2.007811 -0.554871
H -3.525470 1.803063 1.554168
H -4.795062 0.558186 1.627588
H -5.011486 2.002066 0.563173


