%chk=000226626.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226626

0 1
 O   0.9394000       2.472500     -0.4305000    
 O   0.2849000      -2.103600     -0.7430000    
 O   -1.662400      0.3485000       1.230300    
 O   -5.555900      -1.228100     -0.3232000    
 N   0.2054000      0.2517000     -0.7071000    
 N   -3.398900      0.6658000     -0.2816000    
 C    2.335400      0.6008000     -2.1199999E-02
 C    2.138400     -0.7690000     -0.1151000    
 C   -1.162500      0.4775000      -1.129900    
 C    1.090900       1.265200     -0.4062000    
 C   0.7648000      -1.000100     -0.5615000    
 C   -2.070000      0.5018000      8.1600003E-02
 C    3.541800       1.139300      0.3768000    
 C    3.137300      -1.672500      0.1840000    
 C   -4.485800      0.6758000      0.6710000    
 C    4.568700      0.2426000      0.6856000    
 C    4.368400      -1.149700      0.5901000    
 C   -5.039800     -0.7186000      0.8996000    
 H   -1.231800       1.439800      -1.647200    
 H   -1.475200     -0.3331000      -1.796200    
 H    3.696200       2.209400      0.4499000    
 H    2.983900      -2.742700      0.1104000    
 H   -3.632400      0.7735000      -1.264500    
 H   -5.258700       1.329100      0.2527000    
 H   -4.134800       1.103700       1.615500    
 H    5.536400      0.6218000       1.003800    
 H    5.184500      -1.824100      0.8360000    
 H   -5.855400     -0.6919000       1.628100    
 H   -4.270600      -1.406800       1.264600    
 H   -4.822600      -1.251800     -0.9615000    


%chk=000226626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226626

0 1
O 1.398350 2.824853 -0.906055
O -0.803299 -1.312938 -0.472907
O -2.218950 1.840612 0.977597
O -3.533489 -2.143236 0.181071
N 0.005590 0.894714 -0.813687
N -3.439063 0.625351 -0.598907
C 2.211200 0.603491 -0.115017
C 1.546054 -0.642175 0.004567
C -1.241511 1.525344 -1.257141
C 1.237841 1.612519 -0.639390
C 0.127669 -0.464019 -0.432867
C -2.344228 1.352336 -0.184418
C 3.562096 0.747356 0.231661
C 2.209188 -1.785325 0.473761
C -4.463802 0.156249 0.351758
C 4.242937 -0.403854 0.708678
C 3.577472 -1.650013 0.827593
C -3.967136 -1.100088 1.111556
H -1.021489 2.600584 -1.379407
H -1.548228 1.109724 -2.234691
H 4.065659 1.714460 0.138427
H 1.685369 -2.741963 0.563763
H -3.385951 0.133154 -1.492635
H -5.376128 -0.084738 -0.220842
H -4.686590 0.968971 1.065057
H 5.298300 -0.329947 0.991495
H 4.128707 -2.519880 1.199872
H -4.799751 -1.528316 1.696184
H -3.154464 -0.811515 1.807675
H -2.592754 -1.964913 -0.091451


