%chk=000057724.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057724

0 1
 O   0.7860000      -1.525300     -1.0700000E-02
 O   -3.093500     -0.6662000       1.307200    
 O   -3.240300     -0.9713000      -1.079500    
 N    4.196200     -0.1686000     -0.3499000    
 C    5.507000     -0.8167000     -0.4975000    
 C    4.193000      0.7728000      0.7787000    
 C    6.611400      0.2171000     -0.7233000    
 C    5.254500       1.858200      0.5947000    
 C    6.639100       1.252100      0.3954000    
 C    3.145300      -1.171900     -0.1821000    
 C   -2.957300      -1.590600      0.1996000    
 C    1.774500     -0.5147000     -0.1578000    
 C   -1.519400      -2.107800      0.1774000    
 C  -0.5234000     -0.9743000      1.9200001E-02
 C   -3.942100      -2.740300      0.4073000    
 C   -3.454300      0.4770000      0.6608000    
 C   -3.538000      0.3028000     -0.7016000    
 C   -3.716500       1.694100       1.254900    
 C   -3.888400       1.336300      -1.545700    
 C   -4.074200       2.757500      0.4226000    
 C   -4.159600       2.579600     -0.9697000    
 H    5.492300      -1.492900      -1.360800    
 H    5.745200      -1.422200      0.3871000    
 H    4.359000      0.2491000       1.729300    
 H    3.247800       1.315500      0.8593000    
 H    7.582800     -0.2865000     -0.7850000    
 H    6.451100      0.7219000      -1.684500    
 H    4.999700       2.479400     -0.2735000    
 H    5.264400       2.519500       1.468700    
 H    6.967600      0.7755000       1.327100    
 H    7.364700       2.039100      0.1624000    
 H    3.166600      -1.885900      -1.015800    
 H    3.291000      -1.767000      0.7294000    
 H    1.655300      0.1642000      0.6901000    
 H    1.598800      3.8899999E-02  -1.088200    
 H   -1.290000      -2.646800       1.105500    
 H   -1.378800      -2.820800     -0.6450000    
 H  -0.6963000     -0.4298000     -0.9156000    
 H  -0.5927000     -0.2744000      0.8592000    
 H   -3.769900      -3.244200       1.364100    
 H   -3.876100      -3.472300     -0.4045000    
 H   -4.971900      -2.364700      0.4207000    
 H   -3.649200       1.827100       2.328600    
 H   -3.952800       1.194900      -2.618500    
 H   -4.288500       3.731800      0.8531000    
 H   -4.439100       3.418200      -1.601700    


%chk=000057724-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057724

0 1
O 0.883219 -1.360616 0.125991
O -3.159892 -0.456219 1.254798
O -3.202435 -0.855208 -1.116814
N 4.422756 -0.162584 -0.126552
C 5.635710 -0.827908 -0.668239
C 4.734278 0.584904 1.119587
C 6.738661 0.204867 -0.980046
C 5.805000 1.665380 0.867110
C 7.086597 1.033856 0.277620
C 3.279354 -1.093010 0.035237
C -2.908922 -1.524809 0.210286
C 1.936026 -0.358677 -0.083453
C -1.440187 -1.938662 0.254694
C -0.461612 -0.781422 0.029228
C -3.912272 -2.656398 0.418756
C -3.838477 0.589575 0.588181
C -3.863857 0.354941 -0.805760
C -4.399170 1.737501 1.154367
C -4.451343 1.257789 -1.696050
C -5.005209 2.665454 0.260389
C -5.030808 2.430676 -1.133915
H 5.352229 -1.369430 -1.589975
H 6.041012 -1.586774 0.054275
H 5.100122 -0.114209 1.919868
H 3.807753 1.054215 1.497476
H 7.635249 -0.319103 -1.364111
H 6.374646 0.880356 -1.778408
H 5.397890 2.411021 0.157050
H 6.028602 2.190643 1.815861
H 7.551641 0.371469 1.037379
H 7.829675 1.816514 0.033380
H 3.322255 -1.853855 -0.765348
H 3.306387 -1.642632 1.007700
H 1.844722 0.448685 0.676440
H 1.844435 0.102515 -1.089693
H -1.235597 -2.398704 1.238718
H -1.269697 -2.714095 -0.514324
H -0.615464 -0.326637 -0.971926
H -0.598623 0.004301 0.802160
H -3.753932 -3.126303 1.404399
H -3.789926 -3.420804 -0.367422
H -4.942297 -2.264364 0.374472
H -4.370753 1.910717 2.233421
H -4.462011 1.068396 -2.772706
H -5.459797 3.575423 0.665577
H -5.504939 3.160625 -1.798178


