%chk=000086553.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086553

0 1
 O    4.173400      0.3762000     -9.6400000E-02
 O   -3.822000     -0.9925000      0.9726000    
 O   -4.505600      0.5390000     -0.4551000    
 N   -3.635000     -0.1464000      9.1700003E-02
 C   7.6300003E-02 -2.7799999E-02  0.4322000    
 C   0.8316000      -1.110500     -1.8900000E-02
 C   0.6981000       1.190600      0.7055000    
 C   -1.359200     -0.1690000      0.6162000    
 C    2.830200      0.2435000      7.7100001E-02
 C    2.208400     -0.9749000     -0.1962000    
 C    2.075000       1.326200      0.5279000    
 C   -2.286400      5.7999998E-02 -0.3348000    
 C   -2.169700      0.4581000      -1.761500    
 C    4.884700     -0.7705000     -0.5604000    
 H   0.3605000      -2.066300     -0.2359000    
 H   0.1233000       2.043800       1.057500    
 H   -1.621300     -0.4494000       1.634800    
 H    2.734300      -1.855500     -0.5490000    
 H    2.553800       2.277800      0.7422000    
 H   -2.576200       1.461200      -1.929600    
 H   -2.691000     -0.2489000      -2.416600    
 H   -1.124100      0.4792000      -2.086200    
 H    4.556500      -1.069700      -1.561500    
 H    4.830700      -1.595400      0.1581000    
 H    5.938900     -0.4859000     -0.6416000    


%chk=000086553-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086553

0 1
O 4.311156 0.046945 0.385272
O -3.932411 1.015954 1.188053
O -4.761666 0.065549 -0.706308
N -3.768974 0.405953 0.056031
C 0.067412 0.289560 0.328317
C 0.748485 -0.436911 -0.694703
C 0.873528 0.901545 1.344327
C -1.377679 0.457386 0.442610
C 2.920195 0.083544 0.304105
C 2.151573 -0.543583 -0.712089
C 2.269026 0.808557 1.337701
C -2.389073 0.070492 -0.404285
C -2.306321 -0.631546 -1.733832
C 5.046246 -0.686814 -0.652646
H 0.184459 -0.938808 -1.482687
H 0.378550 1.460651 2.147085
H -1.719994 0.981530 1.345588
H 2.635377 -1.113828 -1.510457
H 2.879216 1.280148 2.113236
H -3.304122 -0.674051 -2.194801
H -1.941194 -1.669531 -1.619358
H -1.622255 -0.097601 -2.417885
H 4.864844 -0.251487 -1.653757
H 4.772687 -1.759109 -0.653244
H 6.106136 -0.573647 -0.384173


