%chk=000023698.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023698

0 1
 O   -2.065800      -2.072400     -1.3800000E-02
 N    1.313400       1.005900     -3.7300002E-02
 C  -4.8300002E-02  0.8901000     -6.3299999E-02
 C   -1.005400       2.024400     -0.1148000    
 C  -0.3703000     -0.4507000     -3.5000000E-02
 C   -2.365700       1.545600      0.4187000    
 C   0.8445000      -1.173900      1.9300001E-02
 C   -2.805800      0.2129000     -0.2088000    
 C    1.868800     -0.2489000      1.5000000E-02
 C   -1.753700     -0.8857000     -5.5599999E-02
 C    2.055200       2.248300     -5.5300001E-02
 C    1.000200      -2.641900      7.2999999E-02
 C    3.332900     -0.4537000      5.7799999E-02
 H  -0.6639000       2.870900      0.4902000    
 H   -1.111700       2.367300      -1.150500    
 H   -2.296900       1.415700       1.507200    
 H   -3.125700       2.313200      0.2349000    
 H   -3.000300      0.3443000      -1.279300    
 H   -3.731200     -0.1252000      0.2702000    
 H    2.280200       2.524000      0.9778000    
 H    2.975800       2.116300     -0.6288000    
 H    1.460500       3.027800     -0.5369000    
 H   0.2749000      -3.139200     -0.5787000    
 H    1.991800      -2.965000     -0.2578000    
 H   0.8475000      -3.003100       1.095100    
 H    3.592900      -1.468000      0.3748000    
 H    3.771800     -0.2894000     -0.9316000    
 H    3.810900      0.2291000      0.7681000    


%chk=000023698-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000023698

0 1
O -2.108481 -2.132771 0.018839
N 1.327161 1.037033 -0.065560
C -0.055037 0.930741 -0.064083
C -1.047595 2.059343 -0.120670
C -0.379217 -0.444147 -0.004695
C -2.405608 1.553299 0.437250
C 0.862551 -1.198921 0.046131
C -2.825170 0.202611 -0.192185
C 1.903538 -0.264845 0.008608
C -1.764474 -0.907590 -0.037363
C 2.096538 2.285398 -0.079279
C 0.981444 -2.699385 0.112209
C 3.393751 -0.453445 0.027064
H -0.708362 2.937527 0.463014
H -1.187089 2.407508 -1.167159
H -2.317056 1.428489 1.533792
H -3.188141 2.313917 0.254531
H -3.008156 0.336563 -1.279635
H -3.768820 -0.168524 0.245641
H 2.467252 2.546163 0.930251
H 2.963422 2.192463 -0.754902
H 1.463652 3.108996 -0.444793
H 0.482621 -3.174785 -0.751415
H 2.036116 -3.027250 0.130927
H 0.473961 -3.098100 1.008917
H 3.629760 -1.523451 0.144996
H 3.878460 -0.113268 -0.910158
H 3.879577 0.085132 0.864326


