%chk=000086858.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086858

0 1
 O    2.414300      -1.938800     -0.4527000    
 O   0.2766000      -2.354600     -0.1445000    
 N    1.241500      -1.559500     -0.2277000    
 C   -1.457800     -0.6223000      0.2961000    
 C   -2.782800      1.3800000E-02 -0.1713000    
 C  -0.2724000      0.3220000      0.1917000    
 C   -1.597700      -1.151800       1.728500    
 C   0.9953000     -0.1688000     -5.9099998E-02
 C   -2.772800      0.4020000      -1.644900    
 C  -0.5102000       1.674900      0.3553000    
 C    2.063400      0.7237000     -0.1492000    
 C   0.5579000       2.567400      0.2650000    
 C    1.844700       2.091800      1.2900000E-02
 H   -1.427100      -1.439100     -0.4220000    
 H   -3.095200      0.8610000      0.4479000    
 H   -3.581300     -0.7309000     -4.2100001E-02
 H   -1.842300     -0.3405000       2.424300    
 H   -2.402900      -1.892000       1.788200    
 H  -0.6820000      -1.626000       2.095300    
 H   -3.767800      0.7499000      -1.942100    
 H   -2.067500       1.207800      -1.863000    
 H   -2.520000     -0.4553000      -2.277200    
 H   -1.481400       2.095100      0.5848000    
 H    3.080700      0.3938000     -0.3440000    
 H   0.3897000       3.632100      0.3984000    
 H    2.676300       2.787100     -5.5500001E-02


%chk=000086858-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086858

0 1
O 2.234773 -1.785060 -1.301716
O 0.664628 -2.481334 0.194166
N 1.304279 -1.550002 -0.435909
C -1.544236 -0.635086 0.358245
C -2.832849 -0.021470 -0.258914
C -0.322619 0.286214 0.249784
C -1.767528 -1.022716 1.847846
C 0.986329 -0.130631 -0.131306
C -2.719369 0.290292 -1.766703
C -0.460203 1.670314 0.544782
C 2.079882 0.763540 -0.241073
C 0.619817 2.572879 0.471773
C 1.900058 2.121577 0.070752
H -1.333047 -1.570885 -0.188601
H -3.134765 0.889810 0.295353
H -3.648478 -0.753835 -0.096283
H -1.971566 -0.128133 2.465885
H -2.631603 -1.706448 1.936617
H -0.879589 -1.535876 2.254178
H -3.676648 0.671629 -2.166592
H -1.943462 1.051497 -1.967287
H -2.453513 -0.618611 -2.338587
H -1.446565 2.046500 0.834588
H 3.049288 0.373904 -0.563643
H 0.463236 3.628164 0.720505
H 2.742949 2.816569 0.005239


