%chk=000094728.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094728

0 1
 O    1.812600       1.238700      0.5992000    
 N  -0.5214000       2.291100     -0.2323000    
 N    2.222800     -0.8526000     -0.3178000    
 N    3.593900     -0.6897000     -0.2668000    
 C  -4.8900001E-02 -8.5800000E-02  7.2200000E-02
 C  -0.9609000      0.9542000     -0.1078000    
 C  -0.5035000      -1.399000      0.1931000    
 C   -2.327500      0.6810000     -0.1666000    
 C   -1.870100      -1.672200      0.1341000    
 C    1.385100      0.1664000      0.1383000    
 C   -2.782000     -0.6322000     -4.5699999E-02
 H   0.1695000      -2.234300      0.3644000    
 H   -3.049300       1.481800     -0.3059000    
 H   -2.225200      -2.693600      0.2352000    
 H   -3.846200     -0.8449000     -8.9800000E-02
 H   0.4630000       2.517900     -0.2156000    
 H   -1.199100       3.030100     -0.3662000    
 H    1.877200      -1.708900     -0.7387000    
 H    3.965800      -1.482400      0.2546000    
 H    3.939200     -0.7930000      -1.220100    


%chk=000094728-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094728

0 1
O 1.981592 1.187794 0.007485
N -0.443271 2.238850 -0.167466
N 2.246349 -1.084289 -0.278004
N 3.661706 -0.974059 -0.356933
C -0.042198 -0.187587 -0.037681
C -0.931909 0.950400 -0.104048
C -0.608527 -1.490067 0.079062
C -2.345007 0.714393 -0.106835
C -1.996369 -1.703339 0.090155
C 1.428685 0.028692 -0.089890
C -2.864429 -0.583221 -0.015767
H 0.046998 -2.361094 0.196928
H -3.021824 1.575314 -0.170781
H -2.402369 -2.714604 0.188106
H -3.950449 -0.730926 -0.013861
H 0.577926 2.356748 -0.095916
H -1.080706 3.028380 -0.227692
H 1.872829 -1.998247 -0.527176
H 4.050603 -0.751749 0.571437
H 3.915369 -0.228790 -1.023322


