%chk=000031208.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031208

0 1
 O    4.782200     -0.8485000     -7.5700000E-02
 N  -0.4245000       1.103800     -7.1999999E-03
 C   0.8940000      0.6089000     -2.4100000E-02
 C   -1.683100      0.4679000      2.4700001E-02
 C    1.926900       1.350600      0.5516000    
 C    1.170800     -0.6241000     -0.6170000    
 C   -2.788200       1.079400     -0.5673000    
 C   -1.822700     -0.7724000      0.6474000    
 C    3.232800      0.8608000      0.5343000    
 C    2.476800      -1.113900     -0.6344000    
 C    3.507800     -0.3714000     -5.8699999E-02
 C   -4.032800      0.4504000     -0.5370000    
 C   -3.067400      -1.401300      0.6778000    
 C   -4.172500     -0.7900000      8.5600004E-02
 H  -0.4806000       2.118400     -1.8999999E-02
 H    1.725300       2.311800       1.017700    
 H   0.3919000      -1.213700      -1.092700    
 H   -2.692000       2.045300      -1.056500    
 H  -0.9848000      -1.261800       1.135900    
 H    4.027100       1.448800      0.9864000    
 H    2.685800      -2.072100      -1.102100    
 H   -4.893300      0.9264000     -0.9980000    
 H   -3.177500      -2.364700       1.166900    
 H   -5.141900      -1.279200      0.1103000    
 H    5.365000     -0.2068000      0.3656000    


%chk=000031208-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000031208

0 1
O 4.865363 -0.887482 -0.005802
N -0.438297 1.126422 -0.060093
C 0.874563 0.591345 -0.016802
C -1.677010 0.449874 -0.023516
C 1.929233 1.408875 0.472342
C 1.196105 -0.707937 -0.503531
C -2.838317 1.143494 -0.473748
C -1.826596 -0.870596 0.489154
C 3.263189 0.950636 0.475507
C 2.523229 -1.175410 -0.481883
C 3.561240 -0.350688 0.007885
C -4.107148 0.533955 -0.416379
C -3.101594 -1.473200 0.529515
C -4.251210 -0.784589 0.077252
H -0.496753 2.143420 -0.129676
H 1.702933 2.409681 0.859768
H 0.413708 -1.341736 -0.929712
H -2.736950 2.159910 -0.875897
H -0.960527 -1.406743 0.886849
H 4.060166 1.603570 0.854660
H 2.772867 -2.172194 -0.857549
H -4.985469 1.087691 -0.767432
H -3.196515 -2.488165 0.932731
H -5.236283 -1.261021 0.113272
H 5.515173 -0.236509 0.357587


