%chk=000039043.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039043

0 1
 O    2.579900      0.7286000     -0.2860000    
 O   0.8504000       2.211200     -0.5384000    
 N   -1.146100     -0.4508000     -0.9554000    
 C   0.5340000      0.1394000      0.7111000    
 C    1.386700      -1.104300      0.5245000    
 C    2.775600     -0.5139000      0.4048000    
 C    1.288600       1.153900     -0.1121000    
 C  -0.9086000     -4.0100001E-02  0.3133000    
 C    3.734500      -1.391000     -0.3778000    
 C   -1.911200      0.2161000       1.238900    
 C   -3.231600      4.0899999E-02  0.8398000    
 C   -2.441800     -0.6101000      -1.307000    
 C   -3.510400     -0.3799000     -0.4558000    
 H   0.6063000      0.4737000       1.754700    
 H    1.299000      -1.811900       1.355100    
 H    1.117400      -1.639900     -0.3946000    
 H    3.198200     -0.2871000       1.391000    
 H    3.875200      -2.359200      0.1118000    
 H    3.373100      -1.559800      -1.398100    
 H    4.708900     -0.8995000     -0.4701000    
 H   -1.687500      0.5443000       2.248400    
 H   -4.041800      0.2319000       1.537000    
 H   -2.605600     -0.9395000      -2.327700    
 H   -4.532000     -0.5232000     -0.7887000    


%chk=000039043-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000039043

0 1
O 2.560572 0.853615 0.263661
O 0.769141 2.284260 0.603913
N -1.282006 -1.294623 -0.375723
C 0.498841 -0.200972 0.939178
C 1.442758 -1.286924 0.381388
C 2.839340 -0.625292 0.416638
C 1.224702 1.128556 0.591993
C -0.942663 -0.250498 0.438413
C 3.803221 -1.043752 -0.688559
C -1.876677 0.747235 0.820650
C -3.202594 0.657456 0.347382
C -2.568853 -1.369018 -0.825275
C -3.562200 -0.422746 -0.492245
H 0.478736 -0.240866 2.049417
H 1.412988 -2.220238 0.966096
H 1.142145 -1.531302 -0.651205
H 3.310051 -0.735162 1.413363
H 4.031016 -2.121772 -0.597559
H 3.355481 -0.863356 -1.681045
H 4.750035 -0.481454 -0.622786
H -1.554982 1.581045 1.450530
H -3.939889 1.418255 0.624456
H -2.797900 -2.222238 -1.474183
H -4.580062 -0.530408 -0.879797


