%chk=000132833.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132833

0 1
 O   0.2271000       2.639800     -4.2500000E-02
 N   0.2301000      0.2543000      1.2600000E-02
 N    3.985300      -1.974400     -0.1619000    
 C    2.532700     -3.2900002E-02 -0.3208000    
 C    1.268500     -0.7528000      0.1231000    
 C    2.280400       1.404800      0.1116000    
 C   0.7800000       1.550100     -5.4000001E-03
 C    3.798900     -0.6244000      0.2729000    
 C   -1.156700     -8.1400000E-02  7.0000002E-03
 C   -2.124300      0.9270000     -1.8600000E-02
 C   -1.556300      -1.420800      2.7400000E-02
 C   -3.480000      0.5988000     -2.3800001E-02
 C   -2.912000      -1.748900      2.2000000E-02
 C   -3.873900     -0.7391000     -3.7000000E-03
 H    2.587200     -5.4200001E-02  -1.419200    
 H    1.079200      -1.602500     -0.5398000    
 H    1.316000      -1.086500       1.165900    
 H    2.789000       2.118600     -0.5421000    
 H    2.566700       1.586400       1.152900    
 H    3.756700     -0.5976000       1.367900    
 H    4.662000     -1.8700000E-02 -2.6699999E-02
 H    4.864300      -2.340000      0.2012000    
 H    4.057800      -2.013500      -1.177600    
 H   -1.890600       1.982900     -3.4200002E-02
 H  -0.8480000      -2.242200      6.0199998E-02
 H   -4.230000       1.384300     -4.3200001E-02
 H   -3.219500      -2.790500      4.0700000E-02
 H   -4.929500     -0.9945000     -7.0000002E-03


%chk=000132833-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000132833

0 1
O 0.141291 2.690068 0.126163
N 0.228145 0.308631 -0.031528
N 3.988009 -2.021898 -0.182000
C 2.593251 0.020630 -0.370187
C 1.277697 -0.745626 -0.066750
C 2.304757 1.462145 0.106928
C 0.777370 1.600977 0.063018
C 3.825114 -0.629724 0.284831
C -1.157915 -0.034355 -0.000493
C -2.175974 0.959636 -0.076787
C -1.536066 -1.403001 0.105919
C -3.532632 0.576802 -0.052999
C -2.898713 -1.767481 0.126453
C -3.908504 -0.783010 0.045451
H 2.738765 0.036527 -1.469351
H 1.049561 -1.497022 -0.839836
H 1.339056 -1.272282 0.906155
H 2.769218 2.248813 -0.509018
H 2.636613 1.623236 1.152295
H 3.670833 -0.652646 1.381556
H 4.713233 0.021655 0.097970
H 4.621860 -2.590796 0.386762
H 4.200607 -2.102168 -1.182031
H -1.891249 2.010861 -0.144353
H -0.777051 -2.186778 0.182960
H -4.302544 1.354501 -0.113163
H -3.167977 -2.826592 0.209557
H -4.965655 -1.069004 0.061378


