%chk=000101247.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101247

0 1
 O    1.056900     -0.8147000     -0.2619000    
 O    3.068200       2.322200       1.510300    
 O    4.556600      0.2223000      0.2004000    
 O    2.282000      -3.052700      -1.274900    
 O   -1.503900       1.993500      -1.842000    
 O   -4.946700     -0.2068000      0.2685000    
 N  -0.9582000      0.3288000     -0.2988000    
 N   -3.211200      0.8886000     -0.7815000    
 C    2.550500       1.542800      0.4353000    
 C    3.164500      0.1425000      0.4953000    
 C    1.030500       1.468100      0.5476000    
 C   0.4646000      0.4690000     -0.4544000    
 C    2.469000     -0.8039000     -0.4918000    
 C    2.971200      -2.236500     -0.3455000    
 C   -1.436400     -0.6207000      0.5954000    
 C   -1.856400       1.132800      -1.032900    
 C   -2.733300     -0.8519000      0.8334000    
 C   -3.741600     -4.4000000E-02  9.6900001E-02
 C   -3.226500      -1.879500       1.800600    
 H    2.832900       2.047400     -0.4966000    
 H    3.073900     -0.2432000       1.518400    
 H   0.7685000       1.172700       1.573000    
 H   0.5934000       2.464200      0.4062000    
 H   0.6724000      0.8061000      -1.478100    
 H    2.648000     -0.4869000      -1.528300    
 H    2.760300      -2.622700      0.6573000    
 H    4.045100      -2.307600     -0.5424000    
 H    4.036700       2.331400       1.423000    
 H    4.650600      0.5535000     -0.7091000    
 H  -0.6965000      -1.189700       1.149200    
 H   -3.876700       1.455900      -1.299200    
 H    2.613600      -3.959800      -1.161600    
 H   -3.824000      -1.408100       2.587700    
 H   -2.403100      -2.415500       2.284500    
 H   -3.848700      -2.620000       1.287600    


%chk=000101247-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101247

0 1
O 1.054750 -0.845400 -0.313084
O 3.080771 2.283464 1.644442
O 4.644320 0.198786 0.316163
O 2.883210 -2.731056 -1.943605
O -1.431534 1.566202 -2.186567
O -5.062825 -0.312527 0.082018
N -1.006457 0.288739 -0.247569
N -3.212655 0.596836 -1.012253
C 2.552950 1.493799 0.534537
C 3.183802 0.086815 0.515063
C 1.027828 1.418512 0.696256
C 0.441622 0.496219 -0.391897
C 2.513347 -0.800928 -0.561650
C 3.019027 -2.239485 -0.565442
C -1.504865 -0.487309 0.804406
C -1.855958 0.865769 -1.225974
C -2.843089 -0.737098 0.992291
C -3.806847 -0.168967 0.036367
C -3.380820 -1.580269 2.121449
H 2.797299 1.984612 -0.439709
H 3.088326 -0.372951 1.514471
H 0.793420 1.026376 1.703199
H 0.592634 2.429872 0.612666
H 0.593205 0.930969 -1.399727
H 2.700667 -0.364807 -1.571151
H 2.409029 -2.830591 0.147760
H 4.080831 -2.253459 -0.245542
H 4.068708 2.176133 1.641369
H 4.824448 0.481201 -0.619020
H -0.741101 -0.913717 1.458488
H -3.856756 1.002597 -1.698819
H 3.003637 -3.712658 -1.963619
H -4.099538 -1.003979 2.731634
H -2.569648 -1.942410 2.775862
H -3.935541 -2.451690 1.728787


