%chk=000094859.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094859

0 1
 O    5.431000      0.1217000     -0.4743000    
 O    4.769500      -1.750800      0.4613000    
 N  -0.7545000       1.306900      9.9500000E-02
 N    4.528600     -0.6074000      3.8000001E-03
 C   -2.006200      0.6604000      3.0099999E-02
 C   0.5695000      0.8271000      7.5700000E-02
 C   -4.481600     -0.6190000     -0.1050000    
 C   -3.114100       1.215700      0.6702000    
 C   -2.135900     -0.5349000     -0.6773000    
 C   -4.351700      0.5760000      0.6027000    
 C   -3.373600      -1.174500     -0.7449000    
 C    1.591000       1.619400     -0.4507000    
 C   0.8628000     -0.4415000      0.5785000    
 C    3.193800     -0.1237000      2.8000001E-02
 C    2.902200       1.144300     -0.4747000    
 C    2.174100     -0.9165000      0.5547000    
 C   -5.804800      -1.303200     -0.1776000    
 H  -0.8218000       2.317500      0.1831000    
 H   -3.025400       2.146100       1.225200    
 H   -1.295500     -0.9787000      -1.204000    
 H   -5.207800       1.019300       1.104300    
 H   -3.463800      -2.101700      -1.304600    
 H    1.375900       2.608900     -0.8464000    
 H   9.2699997E-02  -1.071800       1.014800    
 H    3.670800       1.789400     -0.8927000    
 H    2.365100      -1.907200      0.9594000    
 H   -5.684200      -2.389300     -0.2511000    
 H   -6.401000      -1.107500      0.7202000    
 H   -6.361800     -0.9519000      -1.051800    


%chk=000094859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094859

0 1
O 5.571422 0.291070 -0.179224
O 4.849032 -1.803729 0.384220
N -0.739336 1.318454 -0.061090
N 4.629179 -0.560497 0.086420
C -1.982273 0.622146 -0.039493
C 0.561188 0.808302 -0.031792
C -4.556167 -0.642450 -0.035481
C -3.100421 1.255154 0.565470
C -2.163144 -0.644520 -0.655003
C -4.363982 0.631490 0.559492
C -3.430867 -1.261774 -0.637947
C 1.642708 1.696710 -0.332678
C 0.862527 -0.542718 0.325828
C 3.241976 -0.091478 0.049094
C 2.970108 1.256156 -0.291923
C 2.191702 -0.985935 0.365534
C -5.923196 -1.302812 -0.056318
H -0.811863 2.338035 -0.082227
H -2.972998 2.228454 1.055379
H -1.331288 -1.129462 -1.174181
H -5.212266 1.137450 1.035807
H -3.549814 -2.239868 -1.119500
H 1.425042 2.735748 -0.608225
H 0.059432 -1.225981 0.610536
H 3.802796 1.924770 -0.524958
H 2.437146 -2.012637 0.650193
H -5.841579 -2.403914 -0.056129
H -6.530097 -1.006581 0.817366
H -6.491667 -1.016484 -0.962771


