%chk=000122155.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122155

0 1
 O   -4.292200      -1.997300     -0.3573000    
 O  -0.3366000       1.908300      0.9340000    
 O    3.333200       1.108800      -1.977300    
 O   -1.294400       3.140000     -0.7136000    
 O    2.580700       2.143000     -0.1065000    
 N  -0.5930000      -2.356300     -0.2982000    
 N   -3.784900       2.493600      1.5400000E-02
 N    3.953000      0.6085000       1.572500    
 C   -2.952500      -1.691800     -0.7492000    
 C   -2.742500     -0.1736000     -0.6570000    
 C   -1.990100      -2.555000      7.5700000E-02
 C    1.744400      -2.952100      0.1290000    
 C   -2.839200      0.3678000      0.7740000    
 C   0.2850000      -3.174100      0.5258000    
 C    2.149100      -1.487900      0.3178000    
 C    3.599900      -1.194600     -8.7499999E-02
 C   -2.722700       1.898600      0.8231000    
 C    4.054800      0.2497000      0.1572000    
 C   -1.406600       2.399500      0.2546000    
 C    3.254700       1.264700     -0.6327000    
 H   -2.869800      -1.980200      -1.804200    
 H   -3.508300      0.3002000      -1.282600    
 H   -1.769000      8.0600001E-02  -1.091500    
 H   -2.135700      -2.351600       1.143800    
 H   -2.268700      -3.608100     -6.4099997E-02
 H    1.900400      -3.249800     -0.9152000    
 H    2.386000      -3.593400      0.7449000    
 H   -2.044000     -6.8000004E-02   1.389500    
 H   -3.791500      7.1599998E-02   1.229700    
 H    1.998400      -1.219500       1.370400    
 H    1.491400     -0.8376000     -0.2705000    
 H   4.5400001E-02  -4.236900      0.4024000    
 H   0.1581000      -2.923600       1.586000    
 H  -0.4637000      -2.587100      -1.282700    
 H    3.721000      -1.436600      -1.151100    
 H    4.265300      -1.874700      0.4604000    
 H   -2.810800       2.256800       1.854700    
 H    5.103400      0.3559000     -0.1448000    
 H   -4.348600      -1.940500      0.6112000    
 H   -4.692700       2.187600      0.3639000    
 H   -3.769100       3.507600      0.1210000    
 H    4.495500     -4.9300000E-02   2.131100    
 H    4.373400       1.524700       1.724900    
 H   0.5116000       2.224300      0.5565000    
 H    2.796100       1.776200      -2.455200    


%chk=000122155-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122155

0 1
O -4.365631 -2.087584 -0.009973
O -0.399569 1.994683 1.531061
O 2.038421 1.607167 -1.073696
O -0.404625 2.234238 -0.773610
O 2.077448 1.613008 1.241478
N -0.611608 -2.506773 -0.228223
N -3.242617 2.669239 -0.715384
N 4.636670 0.394414 1.284755
C -3.001360 -1.819935 -0.509978
C -2.722314 -0.307579 -0.685750
C -1.967416 -2.577398 0.360921
C 1.831080 -2.979662 -0.062367
C -2.967011 0.541038 0.583223
C 0.416434 -3.332298 0.453192
C 2.265570 -1.569059 0.393901
C 3.425220 -0.974842 -0.436921
C -2.558088 2.043283 0.418301
C 3.877474 0.451233 0.031368
C -1.021461 2.114607 0.344054
C 2.602024 1.307779 0.111559
H -3.015148 -2.287757 -1.513774
H -3.378663 0.067552 -1.493337
H -1.671706 -0.205016 -1.019382
H -1.925194 -2.135994 1.378368
H -2.346492 -3.621625 0.476822
H 1.833001 -3.032242 -1.171822
H 2.552987 -3.743045 0.288697
H -2.416505 0.129375 1.450815
H -4.047046 0.552080 0.824955
H 2.540488 -1.605370 1.467661
H 1.372408 -0.920110 0.310159
H 0.228526 -4.427810 0.336999
H 0.357127 -3.115769 1.538684
H -0.633482 -2.721207 -1.237008
H 3.114339 -0.911841 -1.497020
H 4.323713 -1.616024 -0.376365
H -2.853162 2.563660 1.347313
H 4.523639 0.872493 -0.759469
H -4.471049 -1.654666 0.875468
H -3.271757 3.692198 -0.664076
H -2.885316 2.354360 -1.623753
H 5.179797 1.243582 1.472509
H 4.050431 0.154956 2.092324
H 0.664341 1.911468 1.456224
H 1.040281 1.969595 -0.990600


