%chk=000125426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125426

0 1
 O   0.3521000       1.037700      0.3340000    
 O    1.366600      -2.296200     -0.6935000    
 O    3.519700      -1.572600       1.031100    
 O    4.766100      0.2831000     -0.6218000    
 O   -1.933600      -3.372400     -0.1178000    
 O   0.5709000       3.322200       1.426800    
 O   -1.294400       4.195800      0.4330000    
 N   -1.656100      -1.135600      0.4617000    
 N   -3.274100      3.4200002E-02  -1.542500    
 C   0.3868000     -0.1290000     -0.5074000    
 C   -1.024900     -0.6918000     -0.7672000    
 C    1.331600      -1.138500      0.1372000    
 C   -1.857200      0.3975000      -1.482900    
 C    2.746100     -0.5819000      0.3444000    
 C   -1.644200       1.736300     -0.8300000    
 C  -0.6172000       1.957700      5.5999998E-03
 C    3.485800     -0.2503000     -0.9497000    
 C   -2.054300      -2.441800      0.6745000    
 C  -0.5133000       3.280300      0.6238000    
 C   -2.656500      -2.634700       2.040500    
 H   0.7956000      0.1732000      -1.481300    
 H  -0.9543000      -1.551500      -1.445300    
 H   0.9512000      -1.457600       1.114600    
 H   -1.500500      0.4856000      -2.517200    
 H    2.722400      0.2964000      0.9995000    
 H   -2.353300       2.524000      -1.071400    
 H   -1.799700     -0.4496000       1.197300    
 H   -3.807100      0.7733000      -1.998500    
 H   -3.648700     -6.4599998E-02 -0.6000000    
 H    2.957100      0.4987000      -1.543900    
 H    3.656300      -1.146200      -1.554600    
 H    1.585800      -2.019500      -1.599100    
 H    4.408200      -1.202800       1.172100    
 H   -3.111300      -3.627000       2.106100    
 H   -1.874800      -2.546500       2.800000    
 H   -3.429200      -1.882300       2.222700    
 H    5.215400      0.4814000      -1.461100    
 H   0.6749000       4.196100       1.860600    


%chk=000125426-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125426

0 1
O 0.357220 0.936389 0.192919
O 1.592433 -2.141453 -1.356974
O 3.476629 -1.881373 0.567476
O 4.754616 0.322456 -0.120150
O -2.223135 -3.287638 -0.029264
O 0.829728 3.309260 1.225730
O -1.153491 4.227515 0.429843
N -1.657655 -1.080562 0.481131
N -3.405478 0.000655 -1.501812
C 0.321846 -0.235500 -0.740522
C -1.128442 -0.758374 -0.852575
C 1.321048 -1.268215 -0.210713
C -1.979515 0.335228 -1.570986
C 2.644628 -0.685315 0.330487
C -1.646833 1.708348 -0.975930
C -0.593139 1.924890 -0.131104
C 3.372934 0.250414 -0.647102
C -2.145253 -2.347336 0.811585
C -0.371138 3.248720 0.511652
C -2.578343 -2.512102 2.267075
H 0.657868 0.117449 -1.736647
H -1.150723 -1.694197 -1.436666
H 0.863231 -1.851872 0.614604
H -1.686898 0.323799 -2.640277
H 2.462990 -0.151384 1.281882
H -2.314040 2.551039 -1.186701
H -1.522299 -0.391641 1.225367
H -4.025591 0.566033 -2.085526
H -3.755822 -0.163013 -0.554484
H 2.894296 1.247319 -0.639944
H 3.368503 -0.181549 -1.668406
H 2.338533 -2.731876 -1.062846
H 4.417187 -1.556196 0.606311
H -3.627840 -2.851736 2.293060
H -1.969357 -3.305007 2.734934
H -2.485118 -1.589795 2.866482
H 5.324906 0.860950 -0.719958
H 0.909416 4.216772 1.628348


