%chk=000055363.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055363

0 1
 O   0.4771000       1.184700       1.327900    
 O   -2.607700      -1.750800     -0.7095000    
 O   -4.222700     -0.7240000      0.4955000    
 O    4.692100     -0.7754000      0.4330000    
 N  -0.7947000      9.6600004E-02 -0.2788000    
 N    2.726000     -0.1171000      0.4042000    
 N    3.558400      -1.040600      2.0300001E-02
 C    1.609400      8.6300001E-02 -0.5153000    
 C   -2.088800      0.3930000      0.2905000    
 C   0.3956000      0.5229000      0.2951000    
 C    1.964200       1.148100      -1.548700    
 C   -2.626400       1.706100     -0.2577000    
 C   -3.082600     -0.7298000      4.3400001E-02
 H    1.352100     -0.8510000      -1.029500    
 H   -1.966600      0.4708000       1.377400    
 H  -0.7687000     -0.4210000      -1.152600    
 H    2.829400      0.8507000      -2.151000    
 H    2.189500       2.111700      -1.076800    
 H    1.124500       1.315500      -2.232600    
 H   -3.594700       1.954500      0.1898000    
 H   -1.936000       2.531400     -5.2900001E-02
 H   -2.767500       1.651800      -1.343300    
 H    3.217600      0.7483000      0.6178000    
 H   -3.279200      -2.454100     -0.8392000    


%chk=000055363-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055363

0 1
O 0.483728 1.103520 1.282743
O -2.776561 -1.470680 -1.159910
O -4.310350 -0.693933 0.407506
O 4.940215 -0.231008 0.867035
N -0.780390 -0.034437 -0.300582
N 2.810334 0.151585 0.344078
N 4.000282 -0.439452 0.013141
C 1.673052 -0.000579 -0.571093
C -2.061593 0.308823 0.340245
C 0.411177 0.399276 0.225398
C 1.830554 0.879395 -1.841464
C -2.498892 1.772984 0.052970
C -3.169003 -0.648293 -0.087464
H 1.608990 -1.063396 -0.874341
H -1.937715 0.207138 1.435546
H -0.811971 -0.647755 -1.118715
H 2.773210 0.616723 -2.350363
H 1.862274 1.948661 -1.569629
H 0.992322 0.718822 -2.543092
H -3.448807 1.991160 0.569018
H -1.720616 2.454277 0.432243
H -2.631007 1.938875 -1.030272
H 2.689495 0.712343 1.208633
H -3.528427 -2.065450 -1.424628


