%chk=000125868.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125868

0 1
 O   -1.882800     -0.3593000      9.4700001E-02
 O   -4.022700      0.7130000      -1.354600    
 O   0.4103000       2.123500      0.5901000    
 O    4.065200     -0.2176000     -0.9424000    
 N   0.3906000     -0.1963000      0.5980000    
 N    2.246600       1.018200     -0.1819000    
 N    1.011600      -1.383900      0.3381000    
 C  -0.9444000     -0.3202000       1.159300    
 C   -3.216300     -0.4465000      0.5783000    
 C   0.9688000       1.048700      0.3546000    
 C   -4.168800     -0.4846000     -0.6011000    
 C    2.942700     -0.1252000     -0.4730000    
 C    2.199200      -1.369700     -0.1601000    
 H   -1.146400      0.5454000       1.800000    
 H   -1.002600      -1.236300       1.758700    
 H   -3.334300      -1.354400       1.180000    
 H   -3.427700      0.4305000       1.201200    
 H   -5.208700     -0.5736000     -0.2738000    
 H   -3.931100      -1.320100      -1.266200    
 H    2.698000       1.908300     -0.3714000    
 H    2.729700      -2.308900     -0.3821000    
 H   -4.252800       1.456300     -0.7713000    


%chk=000125868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125868

0 1
O -2.151971 -1.356816 1.203150
O -2.035794 0.547873 -1.313276
O -0.549100 1.832406 0.815213
O 3.030783 0.374998 -1.838707
N 0.108249 -0.433463 0.887435
N 1.269386 1.104702 -0.470721
N 0.899007 -1.484562 0.452954
C -0.971876 -0.815142 1.830084
C -3.175301 -0.398419 0.731741
C 0.217098 0.903700 0.431343
C -3.168915 -0.222466 -0.793343
C 2.131951 0.105402 -0.999750
C 1.845649 -1.229521 -0.435775
H -1.202681 0.080215 2.435310
H -0.564840 -1.633761 2.440735
H -4.141791 -0.844451 1.033019
H -3.052974 0.577451 1.246666
H -4.132924 0.246659 -1.091838
H -3.095176 -1.209821 -1.277503
H 1.388929 2.061908 -0.820142
H 2.457216 -2.073438 -0.762240
H -1.980826 1.413847 -0.829254


