%chk=000125533.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125533

0 1
 O   -2.181400       1.993800     -0.2924000    
 O   -3.480800     -0.4628000     -0.2331000    
 N    2.470100      0.5643000       1.740000    
 N    2.704300     -0.3662000      -1.886800    
 C    2.104900     -0.1944000      0.5238000    
 C   0.6287000     -0.2617000      0.3228000    
 C    2.895700      0.4145000     -0.6659000    
 C  -0.1000000      0.9078000      0.1064000    
 C  -2.3499999E-02  -1.494400      0.3522000    
 C   -1.480800      0.8447000     -8.0700003E-02
 C   -1.404300      -1.557600      0.1652000    
 C   -2.132900     -0.3880000     -5.1399998E-02
 H    2.493200      -1.209700      0.6801000    
 H    3.966700      0.4225000     -0.4302000    
 H    2.597900       1.452700     -0.8541000    
 H   0.3937000       1.876000      8.1500001E-02
 H   0.5291000      -2.415100      0.5195000    
 H    1.969700      0.1856000       2.543200    
 H    2.183300       1.537500       1.646000    
 H   -1.899700      -2.524500      0.1904000    
 H    3.234000      6.1700001E-02  -2.645200    
 H    1.726300     -0.3305000      -2.170700    
 H   -3.120500       1.763700     -0.4016000    
 H   -3.756400      -1.394100     -0.1805000    


%chk=000125533-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125533

0 1
O -2.378229 1.984622 0.132491
O -3.545346 -0.398706 -0.347452
N 2.548507 0.857492 1.676611
N 2.649248 -0.637170 -1.775668
C 2.150596 -0.088518 0.614054
C 0.634636 -0.205063 0.367495
C 2.900072 0.319251 -0.686312
C -0.191364 0.949310 0.373123
C 0.046232 -1.468883 0.112857
C -1.570278 0.840786 0.125484
C -1.343774 -1.588225 -0.133436
C -2.145761 -0.434110 -0.125494
H 2.528606 -1.091392 0.887240
H 3.979694 0.319023 -0.453823
H 2.612618 1.374800 -0.930145
H 0.220227 1.943455 0.577481
H 0.677814 -2.363498 0.103806
H 2.109340 0.673226 2.584463
H 2.460900 1.844312 1.408739
H -1.790111 -2.572894 -0.323566
H 3.317100 -0.583208 -2.548702
H 1.676297 -0.662274 -2.095709
H -3.315310 1.712473 -0.054831
H -3.914416 -1.299010 -0.510204


