%chk=000072997.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072997

0 1
 O   -1.271400      8.9999996E-03 -0.7715000    
 O   0.2359000       2.337800     -0.3839000    
 O   -1.889600      5.8899999E-02   1.473000    
 N    2.043200      -1.189000      0.1989000    
 C   0.7156000      -1.194800     -0.1812000    
 C   5.0600000E-02 -3.9400000E-02 -0.3928000    
 C   0.7861000       1.256200     -0.2061000    
 C   7.9899997E-02  -2.546600     -0.3382000    
 C    2.744700     -3.0600000E-02  0.3793000    
 C    2.216800       1.185800      0.2056000    
 C   -2.156000      5.1300000E-02  0.2779000    
 C   -3.555700      0.1014000     -0.2609000    
 H    2.513800      -2.072400      0.3510000    
 H   0.6466000      -3.149800      -1.055900    
 H  -0.9514000      -2.495200     -0.6997000    
 H   7.0600003E-02  -3.073200      0.6220000    
 H    3.775000     -0.1788000      0.6776000    
 H    2.777600       2.099600      0.3498000    
 H   -3.749900     -0.7848000     -0.8703000    
 H   -3.693600       1.012100     -0.8491000    
 H   -4.264800      0.1120000      0.5718000    


%chk=000072997-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072997

0 1
O -1.340597 -0.413535 -0.558402
O -0.230277 2.123977 -0.164215
O -2.047902 0.252538 1.583321
N 2.186677 -1.228373 0.106721
C 0.819765 -1.407520 -0.128700
C 0.024995 -0.278647 -0.218549
C 0.536848 1.103688 -0.066898
C 0.320902 -2.823133 -0.276737
C 2.751167 0.029840 0.267185
C 1.978232 1.169314 0.189187
C -2.294580 0.139427 0.373763
C -3.566804 0.477950 -0.356951
H 2.777423 -2.058295 0.169828
H 0.828316 -3.346604 -1.109419
H -0.758085 -2.814502 -0.487068
H 0.486560 -3.405994 0.649175
H 3.827906 0.054541 0.454142
H 2.434202 2.154995 0.311716
H -3.782170 -0.267317 -1.139521
H -3.424084 1.454835 -0.853225
H -4.404493 0.552314 0.351947


