%chk=000008389.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008389

0 1
 O   -2.972900       1.430700      0.1716000    
 N    1.775900      0.6880000      3.4200002E-02
 C   0.4600000      0.1760000      8.0000004E-03
 C   0.2299000      -1.194600     -0.1108000    
 C  -0.6162000       1.058300      0.1029000    
 C   -1.076600      -1.682900     -0.1346000    
 C   -1.922500      0.5701000      7.9099998E-02
 C    1.363500      -2.162400     -0.2141000    
 C    2.215300       1.629500     -0.9751000    
 C    2.696400      0.2880000       1.078600    
 C   -2.152800     -0.8006000     -3.9700001E-02
 H  -0.4486000       2.128200      0.2021000    
 H   -1.272900      -2.748100     -0.2244000    
 H    1.801900      -2.351500      0.7703000    
 H    1.023300      -3.126100     -0.6110000    
 H    2.134500      -1.806600     -0.9053000    
 H    1.886800       1.317300      -1.972500    
 H    3.308200       1.701500     -0.9985000    
 H    1.818100       2.629100     -0.7714000    
 H    2.180900     -0.1543000       1.938500    
 H    3.246400       1.159700       1.450700    
 H    3.430000     -0.4290000      0.6970000    
 H   -3.165800      -1.193500     -5.8899999E-02
 H   -3.801200      0.9218000      0.1386000    


%chk=000008389-Freq.chk
%nprocshared=24
%mem=100GB
#p freq=noraman PBEPBE/SDD

000008389

0 1
O -2.873417 1.577462 -0.142536
N 1.879660 0.528344 -0.220108
C 0.527591 0.076327 -0.106102
C 0.235839 -1.328855 -0.001314
C -0.544069 1.009178 -0.157431
C -1.118954 -1.721447 0.086657
C -1.881751 0.573911 -0.085510
C 1.321815 -2.388322 -0.076773
C 2.116705 1.846464 -0.830115
C 2.805605 0.249842 0.897733
C -2.188236 -0.797761 0.051534
H -0.358427 2.083697 -0.231217
H -1.348198 -2.792254 0.151793
H 1.741019 -2.650159 0.915690
H 0.921296 -3.321173 -0.511077
H 2.159163 -2.039540 -0.707538
H 1.505608 1.957642 -1.741014
H 3.182115 1.919123 -1.116000
H 1.892340 2.701476 -0.148583
H 2.619295 -0.745935 1.323544
H 2.696907 0.996088 1.719256
H 3.851026 0.283242 0.538166
H -3.227767 -1.145062 0.104349
H -3.773566 1.176311 -0.058104


