%chk=000081988.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081988

0 1
 O   -3.592500      0.8445000     -3.8100000E-02
 N    2.947300     -0.5998000      2.1299999E-02
 N   -1.894800     -0.7877000      7.3100001E-02
 C    1.697800      5.3100001E-02 -1.8700000E-02
 C   0.5195000     -0.6905000      4.6300001E-02
 C  -0.7160000     -4.4199999E-02  7.6000001E-03
 C    1.640700       1.442900     -0.1221000    
 C  -0.7733000       1.345600     -9.6000001E-02
 C   0.4051000       2.089100     -0.1608000    
 C    4.103900      6.3000001E-02  0.5903000    
 C    3.088100      -1.947500     -0.4935000    
 C   -3.215300     -0.3196000      4.8999999E-02
 C   -4.210600      -1.448900      0.1419000    
 H   0.5438000      -1.773400      0.1400000    
 H    2.538800       2.050700     -0.1866000    
 H   -1.690700       1.916200     -0.1320000    
 H   0.3616000       3.171400     -0.2441000    
 H    4.536200      0.7710000     -0.1245000    
 H    4.885400     -0.6597000      0.8508000    
 H    3.847600      0.5954000       1.513200    
 H    4.137700      -2.181700     -0.7042000    
 H    2.542600      -2.077100      -1.435100    
 H    2.727100      -2.681100      0.2349000    
 H   -1.769700      -1.795100      0.1478000    
 H   -4.095200      -2.114500     -0.7181000    
 H   -5.227700      -1.047200      0.1469000    
 H   -4.047600      -2.012400       1.065000    


%chk=000081988-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081988

0 1
O -3.637943 0.824524 -0.038089
N 2.969354 -0.609402 0.065274
N -1.908547 -0.770963 -0.022739
C 1.742883 0.069388 0.050908
C 0.507810 -0.643837 0.021313
C -0.733380 0.042385 0.006874
C 1.688755 1.500434 0.065444
C -0.780994 1.459637 0.021455
C 0.445207 2.158464 0.050657
C 4.224655 0.149702 0.092774
C 3.000797 -2.074426 0.047675
C -3.247927 -0.380539 -0.043745
C -4.244833 -1.540906 -0.076590
H 0.507405 -1.739617 0.009380
H 2.607862 2.091420 0.088102
H -1.741632 1.974248 0.009911
H 0.427539 3.254563 0.062206
H 4.331643 0.805002 -0.796162
H 5.075395 -0.550070 0.100513
H 4.301924 0.788523 0.996575
H 4.046584 -2.419868 0.062622
H 2.520707 -2.489219 -0.863681
H 2.488023 -2.511108 0.930488
H -1.737582 -1.778663 -0.030107
H -4.866729 -1.451592 -0.984099
H -4.920773 -1.454700 0.791551
H -3.776403 -2.540882 -0.064210


