%chk=000097857.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097857

0 1
 O   0.4022000      -1.753100      8.9999998E-04
 O    4.579300      0.2269000      6.0000003E-04
 N    2.395100       1.094500     -1.2000001E-03
 N    2.665800      -1.127000      1.3000000E-03
 C    1.142700      0.5492000     -1.1000000E-03
 C  -1.2400000E-02   1.211500     -1.4000000E-03
 C   -1.353300      0.6481000     -6.0000003E-04
 C    1.298600     -0.9297000      5.0000002E-04
 C    3.365300      8.0100000E-02  9.9999997E-05
 C   -1.996400      0.3763000      -1.208300    
 C   -1.996500      0.3796000       1.207800    
 C   -3.282500     -0.1637000      -1.207600    
 C   -3.282500     -0.1605000       1.208300    
 C   -3.925500     -0.4322000      6.9999998E-04
 H   8.2999999E-03   2.300100     -2.2000000E-03
 H    2.584800       2.089700     -2.0000001E-03
 H    3.109400      -2.038500      2.4000001E-03
 H   -1.508500      0.5799000      -2.158400    
 H   -1.508600      0.5858000       2.157500    
 H   -3.783200     -0.3754000      -2.147800    
 H   -3.783400     -0.3698000       2.149100    
 H   -4.926700     -0.8528000      1.3000000E-03


%chk=000097857-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097857

0 1
O 0.493088 -1.873211 0.001095
O 4.705682 0.267700 -0.000765
N 2.463371 1.090655 -0.000860
N 2.752898 -1.125076 0.000350
C 1.154874 0.545719 -0.000370
C -0.019263 1.240097 -0.000519
C -1.386364 0.635458 -0.000120
C 1.347662 -0.957371 0.000529
C 3.464690 0.104831 -0.000444
C -2.055471 0.369776 -1.222933
C -2.056651 0.374155 1.222997
C -3.366040 -0.156993 -1.221589
C -3.367204 -0.152659 1.222283
C -4.026767 -0.418774 0.000500
H 0.033652 2.340628 -0.001033
H 2.696112 2.082124 -0.001502
H 3.225457 -2.028589 0.000724
H -1.542923 0.563800 -2.171891
H -1.545015 0.571571 2.171748
H -3.867512 -0.366673 -2.173085
H -3.869577 -0.358965 2.174040
H -5.042701 -0.829205 0.000745


