%chk=000086537.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086537

0 1
 O   -1.165400      0.4388000     -4.6999998E-02
 O    2.666600       2.330600     -0.7183000    
 O   -1.819400     -0.4139000      -2.090400    
 N   9.1600001E-02  0.5407000     -0.6568000    
 C    3.409200      0.1902000      9.8000001E-03
 C    2.399500       1.248900     -0.2157000    
 C    3.012500      -1.005900      0.5775000    
 C    4.721700      0.4256000     -0.3537000    
 C   0.9657000       1.027800      0.1661000    
 C   -3.388400     -0.1891000     -0.3098000    
 C    3.963800      -2.003700      0.7899000    
 C    5.672900     -0.5723000     -0.1413000    
 C    5.293800      -1.786900      0.4304000    
 C   -4.235300      -1.197900     -0.7218000    
 C   -3.745200      0.7158000      0.6691000    
 C   0.5803000       1.428100       1.558000    
 C   -5.493500      -1.306200     -0.1295000    
 C   -5.003400      0.6073000       1.261500    
 C   -2.049500     -7.4100003E-02 -0.9401000    
 C   -5.877500     -0.4038000      0.8621000    
 H    1.987000      -1.208600      0.8680000    
 H    5.034800       1.364800     -0.7998000    
 H    3.669100      -2.949700       1.234800    
 H    6.708800     -0.4038000     -0.4211000    
 H    6.034500      -2.563900      0.5956000    
 H   -3.946400      -1.908700      -1.490300    
 H   -3.090100       1.520800      0.9885000    
 H    1.449300       1.811900       2.100500    
 H   0.1910000      0.5644000       2.104900    
 H  -0.1768000       2.216900       1.524600    
 H   -6.173900      -2.093800     -0.4398000    
 H   -5.304100       1.311900       2.031400    
 H   -6.857400     -0.4878000       1.323000    


%chk=000086537-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000086537

0 1
O -1.037688 0.376354 0.488106
O 3.152001 2.320881 1.124053
O -1.199283 -1.825340 -0.371324
N 0.422136 0.191096 0.371940
C 3.397966 0.087285 0.265357
C 2.577519 1.254595 0.734154
C 2.880443 -1.157569 -0.197570
C 4.812794 0.272963 0.300731
C 1.045389 1.272903 0.788964
C -3.220046 -0.570171 0.178543
C 3.762779 -2.178736 -0.610711
C 5.685643 -0.749506 -0.112140
C 5.162165 -1.983170 -0.570882
C -4.080574 -1.631636 -0.209284
C -3.770002 0.644764 0.667592
C 0.378143 2.522183 1.310038
C -5.477717 -1.479388 -0.108494
C -5.169375 0.790988 0.765823
C -1.753333 -0.795073 0.048136
C -6.024735 -0.268118 0.379052
H 1.801002 -1.319461 -0.232386
H 5.198540 1.232898 0.658766
H 3.351950 -3.130377 -0.964843
H 6.768841 -0.590068 -0.078154
H 5.839437 -2.782267 -0.893379
H -3.635389 -2.559291 -0.583802
H -3.103163 1.458553 0.964688
H 1.144506 3.260542 1.584687
H -0.247043 2.283662 2.189320
H -0.292677 2.946884 0.541468
H -6.139197 -2.299100 -0.407988
H -5.593951 1.727493 1.142879
H -7.111281 -0.150375 0.456963


