%chk=000026219.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026219

0 1
 O  -0.4447000      -2.298500      0.3087000    
 N   0.3185000     -8.3300002E-02 -4.6000000E-02
 N  -0.3865000       2.631200       1.972500    
 C  -6.4300001E-02   1.335500     -0.2972000    
 C    1.732700     -0.3840000      2.6500000E-02
 C    2.661400      0.4978000     -0.5624000    
 C   0.9351000       2.074900      -1.134700    
 C    2.206300       1.689600      -1.269800    
 C  -0.6481000      -1.103400      0.1005000    
 C    2.226800      -1.524900      0.6802000    
 C    4.035500      0.2169000     -0.5202000    
 C   -2.065700     -0.7412000     -4.3800000E-02
 C    3.598000      -1.792800      0.7260000    
 C    4.501300     -0.9262000      0.1227000    
 C  -0.2446000       2.060300      0.9725000    
 C   -2.669100     -0.8002000      -1.295900    
 C   -2.792700     -0.3421000       1.073000    
 C   -4.014000     -0.4561000      -1.432700    
 C   -4.137600      1.8000000E-03  0.9364000    
 C   -4.748200     -5.5300001E-02 -0.3165000    
 H   -1.004600       1.355100     -0.8550000    
 H   0.5994000       2.968200      -1.656000    
 H    2.903200       2.254900      -1.877600    
 H    1.586600      -2.214300       1.218500    
 H    4.754800      0.8867000     -0.9862000    
 H    3.958900      -2.676800       1.244300    
 H    5.566000      -1.136300      0.1579000    
 H   -2.104900      -1.110700      -2.171200    
 H   -2.326800     -0.2968000       2.053700    
 H   -4.489300     -0.5002000      -2.408200    
 H   -4.709400      0.3137000       1.805500    
 H   -5.795300      0.2126000     -0.4229000    


%chk=000026219-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026219

0 1
O -0.269814 -2.177928 -0.760621
N 0.345333 -0.014920 -0.099954
N 0.020173 2.558971 2.296088
C 0.016232 1.436697 -0.147036
C 1.740086 -0.353370 0.045644
C 2.715886 0.545013 -0.487977
C 0.985008 2.198270 -1.051890
C 2.267771 1.760554 -1.172414
C -0.618625 -1.008814 -0.426628
C 2.148769 -1.545840 0.683860
C 4.091915 0.221955 -0.364847
C -2.077832 -0.641010 -0.350394
C 3.522746 -1.843522 0.801767
C 4.499478 -0.962562 0.278079
C 0.017295 2.047821 1.217924
C -2.932731 -1.136850 -1.369063
C -2.638918 0.049483 0.756663
C -4.322762 -0.910003 -1.303515
C -4.033876 0.257229 0.829295
C -4.877153 -0.210856 -0.204542
H -1.010041 1.533191 -0.541424
H 0.613411 3.102823 -1.541319
H 2.989818 2.312121 -1.785541
H 1.402023 -2.240774 1.072483
H 4.837159 0.912824 -0.776512
H 3.829776 -2.766865 1.304141
H 5.563771 -1.201597 0.371303
H -2.494794 -1.708158 -2.194016
H -1.999836 0.393721 1.577749
H -4.974206 -1.285810 -2.099727
H -4.458984 0.777772 1.693960
H -5.958377 -0.043468 -0.148939


