%chk=000042447.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042447

0 1
 O   0.2055000      -1.249100     -0.4704000    
 O    2.904300      -1.383100     -0.5246000    
 O   -3.763000       1.124600      0.5046000    
 O   -3.846700     -0.7032000     -0.7214000    
 N   -3.238200      0.1771000     -9.7099997E-02
 C   -1.212900      -1.263700     -0.1872000    
 C   -1.819300      9.2900001E-02 -6.8099998E-02
 C   0.2895000       1.144500      1.5300000E-02
 C   0.9019000     -9.2000000E-02 -0.2317000    
 C   -1.164700       1.247100      2.4100000E-02
 C   -1.410200      -2.100000       1.076700    
 C    2.294700     -0.1895000     -0.2764000    
 C    1.085300       2.276600      0.2249000    
 C    3.080500      0.9422000     -6.1799999E-02
 C    2.476900       2.173200      0.1894000    
 C    3.216500      -2.197500      0.6036000    
 H   -1.653300      -1.801400      -1.035100    
 H   -1.618700       2.228800      9.0000004E-02
 H   -2.468900      -2.251900       1.308600    
 H  -0.9394000      -3.082500      0.9591000    
 H  -0.9301000      -1.626700       1.941200    
 H   0.6336000       3.247400      0.4151000    
 H    4.164500      0.8726000     -9.2000000E-02
 H    3.090100       3.054500      0.3537000    
 H    3.922000      -1.683300       1.263800    
 H    3.682600      -3.118400      0.2429000    
 H    2.307600      -2.458300       1.155200    


%chk=000042447-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042447

0 1
O 0.332753 -1.211960 -0.430962
O 3.273842 -1.178136 -0.262457
O -3.868231 1.102518 -0.505757
O -3.804662 -1.183251 -0.336616
N -3.230455 -0.013393 -0.347265
C -1.090608 -1.327019 0.037696
C -1.787993 0.007633 -0.153878
C 0.333725 1.198558 0.077781
C 1.030990 -0.041627 -0.093998
C -1.108704 1.193725 -0.080680
C -1.129339 -1.812472 1.497516
C 2.453491 -0.068785 -0.047715
C 1.058297 2.401915 0.299686
C 3.147020 1.147311 0.179284
C 2.463022 2.371683 0.350406
C 2.805063 -2.541232 0.059681
H -1.520657 -2.088621 -0.630662
H -1.658380 2.137430 -0.163683
H -2.176688 -1.996899 1.793859
H -0.568408 -2.757573 1.597750
H -0.695627 -1.061254 2.180770
H 0.509483 3.341592 0.424195
H 4.239657 1.096991 0.216932
H 3.032727 3.289481 0.523425
H 2.417043 -2.589386 1.094188
H 3.706981 -3.165076 -0.032997
H 2.025756 -2.871253 -0.644098


