%chk=000085984.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085984

0 1
 O    2.797900       1.311800      4.9100000E-02
 C   -1.444800      0.2207000     -3.3900000E-02
 C   3.8100000E-02  0.4718000     -0.4336000    
 C    1.104500     -0.4064000      0.2627000    
 C   -2.316300       1.472600     -0.2058000    
 C   -2.044500     -0.9304000     -0.8624000    
 C   -1.475100     -0.1914000       1.452400    
 C    2.521700     -5.8100000E-02 -0.2175000    
 C   0.8185000      -1.890700     -1.0900000E-02
 H   0.2722000       1.518100     -0.1942000    
 H   0.1427000      0.3937000      -1.524000    
 H    1.086400     -0.2257000       1.343600    
 H   -2.312700       1.806500      -1.249400    
 H   -3.356800       1.284700      8.1699997E-02
 H   -1.945800       2.299900      0.4097000    
 H   -3.124300      -1.006400     -0.6823000    
 H   -1.912300     -0.7484000      -1.934900    
 H   -1.638000      -1.914900     -0.6362000    
 H   -2.515200     -0.2215000       1.803900    
 H   -1.073300      -1.173800       1.688400    
 H  -0.9653000      0.5516000       2.077300    
 H    3.276400     -0.6655000      0.2930000    
 H    2.624900     -0.2206000      -1.295300    
 H    1.698800      -2.487100      0.2612000    
 H   0.6406000      -2.071900      -1.076600    
 H   6.5000001E-03  -2.322600      0.5687000    
 H    2.721400       1.444300       1.009400    


%chk=000085984-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085984

0 1
O 2.410921 1.006447 1.167515
C -1.451860 0.265051 0.110145
C -0.018267 0.340728 -0.511944
C 1.024416 -0.715942 -0.042842
C -2.327549 1.339529 -0.591252
C -2.102428 -1.127984 -0.099406
C -1.396058 0.586581 1.628815
C 2.413895 -0.065195 0.157086
C 1.159552 -1.904344 -1.026897
H 0.379530 1.348277 -0.277369
H -0.110723 0.279273 -1.616629
H 0.710541 -1.122597 0.943765
H -2.411533 1.136508 -1.675933
H -3.349855 1.356140 -0.167911
H -1.891024 2.348794 -0.467505
H -3.134670 -1.135533 0.299783
H -2.153343 -1.386908 -1.174212
H -1.539359 -1.925946 0.419621
H -2.413998 0.596988 2.062590
H -0.807133 -0.165984 2.186919
H -0.938380 1.578346 1.804456
H 3.165908 -0.842428 0.416801
H 2.740292 0.437908 -0.770460
H 1.859785 -2.672198 -0.645463
H 1.540605 -1.555641 -2.006385
H 0.185261 -2.390628 -1.202592
H 2.081674 0.631057 2.023405


