%chk=000131738.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131738

0 1
 O    2.899700      0.5336000     -0.7069000    
 O   -1.070000      -1.017600      -1.533700    
 O   0.8465000      -1.543000       1.188800    
 O   -2.520400      -1.357300      0.1775000    
 N   -2.890600       1.358500      0.3466000    
 N    2.622700     -0.6981000     -7.3200002E-02
 C  -0.4833000       1.162200      0.8066000    
 C   -1.616800      0.8797000     -0.1877000    
 C   0.8391000      0.6749000      0.3110000    
 C    1.396300     -0.6606000      0.5517000    
 C    1.778400       1.270800     -0.4157000    
 C   -1.801800     -0.6032000     -0.4650000    
 H  -0.6952000      0.6932000       1.776300    
 H  -0.4188000       2.242000      0.9943000    
 H   -1.433400       1.394400      -1.138800    
 H    1.778300       2.270200     -0.8139000    
 H   -3.618100       1.261700     -0.3613000    
 H   -2.823800       2.355400      0.5487000    
 H    3.297800      -1.450000     -0.1266000    
 H   -1.191200      -1.975000      -1.710000    


%chk=000131738-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000131738

0 1
O 3.016136 0.609218 -0.611251
O -1.019746 -1.106901 -1.409229
O 0.836665 -1.756697 0.967950
O -2.832480 -1.201699 0.044282
N -2.880603 1.570325 0.147960
N 2.664456 -0.698066 -0.110316
C -0.475078 1.108121 0.764808
C -1.655476 0.943601 -0.293607
C 0.880735 0.660209 0.303020
C 1.379397 -0.733590 0.457301
C 1.866374 1.380789 -0.315377
C -1.926901 -0.545409 -0.513331
H -0.764806 0.549696 1.673635
H -0.467152 2.182038 1.022673
H -1.298205 1.371470 -1.250434
H 1.958118 2.420881 -0.622948
H -3.595278 0.991338 0.580980
H -3.064672 2.548386 -0.039054
H 3.389859 -1.404071 -0.224476
H -1.115943 -2.097840 -1.403885


