%chk=000103337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103337

0 1
 O    1.687600       1.632700     -0.4333000    
 O   -3.165500     -0.5127000      -1.757100    
 N   -2.783100      -1.663900      0.2411000    
 C   -1.800100      0.5444000     -0.2406000    
 C   0.3572000       1.628200     -0.1468000    
 C  -0.4363000      0.5481000     -0.5335000    
 C   -2.627600     -0.5815000     -0.6441000    
 C   -2.370500       1.620900      0.4389000    
 C  -0.2134000       2.704700      0.5327000    
 C   -1.577100       2.700800      0.8257000    
 C    2.401400      0.4703000     -0.1947000    
 C   -3.607500      -2.819200     -8.4299996E-02
 C   -2.127700      -1.701600       1.546600    
 C    2.206800     -0.2075000      0.9951000    
 C    3.290900      1.7700000E-02  -1.152200    
 C    2.926400      -1.378000       1.235700    
 C    4.010400      -1.152900     -0.9117000    
 C    3.828100      -1.850600      0.2823000    
 H  -1.3100000E-02 -0.2887000      -1.084500    
 H   -3.432000       1.628300      0.6728000    
 H   0.3996000       3.548700      0.8367000    
 H   -2.021100       3.538700       1.355200    
 H   -4.060300      -2.712300      -1.073200    
 H   -4.399500      -2.911000      0.6643000    
 H   -2.981200      -3.715700     -7.2099999E-02
 H   -1.513600     -0.8280000       1.763400    
 H   -1.489500      -2.589700       1.585800    
 H   -2.900200      -1.781400       2.317600    
 H    1.528000      0.1519000       1.762900    
 H    3.433600      0.5599000      -2.082100    
 H    2.788300      -1.918800       2.167400    
 H    4.712700      -1.520800      -1.653900    
 H    4.389300      -2.761300      0.4702000    


%chk=000103337-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103337

0 1
O 1.822907 1.544164 -0.356321
O -2.082887 -1.750781 -1.466897
N -3.366463 -1.617896 0.473970
C -1.648588 0.134162 -0.022345
C 0.448492 1.386184 -0.058563
C -0.258466 0.186776 -0.288360
C -2.372082 -1.143879 -0.383705
C -2.325755 1.297722 0.426654
C -0.216663 2.548938 0.393366
C -1.607743 2.499195 0.620873
C 2.729575 0.455487 -0.252395
C -4.170291 -2.774993 0.041762
C -3.555162 -1.206587 1.874747
C 2.662645 -0.493900 0.793841
C 3.778409 0.429210 -1.196539
C 3.659292 -1.491185 0.877244
C 4.770559 -0.570961 -1.096867
C 4.713856 -1.536890 -0.064669
H 0.238084 -0.696503 -0.700797
H -3.408674 1.276542 0.586748
H 0.359838 3.466738 0.541479
H -2.133936 3.401997 0.948818
H -3.969508 -2.961854 -1.023553
H -5.246102 -2.566585 0.193309
H -3.901523 -3.683189 0.616902
H -2.760294 -0.516074 2.189876
H -3.520273 -2.099950 2.529098
H -4.535206 -0.712036 2.025145
H 1.855544 -0.450231 1.531801
H 3.800857 1.185182 -1.987015
H 3.613130 -2.229295 1.685650
H 5.584750 -0.596400 -1.829348
H 5.482676 -2.313410 0.006392


