%chk=000081870.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081870

0 1
 O  -5.2999998E-03   2.445900     -6.0999999E-03
 O   -2.850600     -0.8639000     -0.6950000    
 O    2.861800     -0.8387000     -0.7052000    
 O   6.8000001E-03  -1.408800       1.084800    
 N   -1.181500      0.4248000      0.3090000    
 N    1.182900      0.4314000      0.3061000    
 C   -1.166500       1.712900     -0.3677000    
 C    1.159000       1.719400     -0.3705000    
 C   3.0000000E-03 -0.2745000      0.5982000    
 C   -2.481300     -0.1997000      0.5041000    
 C    2.486600     -0.1859000      0.4983000    
 C   -4.131300      -1.469600     -0.5822000    
 C    4.116400      -1.493200     -0.5738000    
 H   -1.207300       1.553700      -1.451200    
 H   -2.037300       2.298800     -5.9099998E-02
 H    2.027400       2.310000     -6.4000003E-02
 H    1.198000       1.560500      -1.454300    
 H   -3.217200      0.5662000      0.7733000    
 H   -2.413700     -0.9312000       1.316900    
 H    2.421900     -0.9220000       1.307300    
 H    3.218500      0.5821000      0.7722000    
 H   -4.132000      -2.219200      0.2151000    
 H   -4.361900      -1.966100      -1.528500    
 H   -4.897500     -0.7125000     -0.3891000    
 H    4.357200      -1.970600      -1.527400    
 H    4.067100      -2.264900      0.2005000    
 H    4.902700     -0.7701000     -0.3365000    


%chk=000081870-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081870

0 1
O 0.001066 2.415311 -0.180496
O -3.055048 -0.643364 -0.727476
O 3.048590 -0.652705 -0.724739
O -0.004880 -1.396000 1.273081
N -1.188679 0.379778 0.296318
N 1.184713 0.376582 0.297627
C -1.179800 1.622832 -0.501560
C 1.179862 1.619374 -0.500651
C -0.003097 -0.298999 0.638630
C -2.463789 -0.235329 0.564784
C 2.457800 -0.242233 0.567007
C -4.331635 -1.334275 -0.541215
C 4.322322 -1.348553 -0.537268
H -1.197916 1.390047 -1.586878
H -2.058993 2.230851 -0.235443
H 2.060630 2.224974 -0.234232
H 1.197908 1.386213 -1.585896
H -3.149309 0.492680 1.055701
H -2.293562 -1.111320 1.218304
H 2.284618 -1.117432 1.220824
H 3.145240 0.483930 1.057948
H -4.206188 -2.264607 0.051406
H -4.691489 -1.589499 -1.549777
H -5.081660 -0.686315 -0.037626
H 4.681846 -1.605759 -1.545442
H 4.192769 -2.278055 0.055782
H 5.074582 -0.703324 -0.033511


