%chk=000112680.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000112680

0 1
 O    1.506100      0.2490000       1.294400    
 C   0.9068000      1.5200000E-02  1.3900000E-02
 C    1.149700      -1.455000     -0.3452000    
 C    1.635400      0.9154000     -0.9879000    
 C  -0.5438000      0.4373000      0.1041000    
 C   -1.625600     -0.3315000     -9.4999999E-02
 C   -3.028600      0.1697000      1.5699999E-02
 H    2.222500      -1.682100     -0.3401000    
 H   0.6969000      -2.125100      0.3950000    
 H   0.7528000      -1.705600      -1.334700    
 H    1.554900       1.972000     -0.7047000    
 H    1.237600      0.7988000      -2.002000    
 H    2.707800      0.6877000      -1.009200    
 H  -0.7067000       1.481000      0.3719000    
 H   -1.516700      -1.379000     -0.3578000    
 H    1.072000     -0.3348000       1.940300    
 H   -3.548900      3.2699998E-02 -0.9372000    
 H   -3.565300     -0.3940000      0.7849000    
 H   -3.072300       1.231400      0.2783000    


%chk=000112680-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000112680

0 1
O 1.594201 0.303541 1.302325
C 0.924199 0.008718 -0.009274
C 1.123961 -1.481664 -0.351987
C 1.675144 0.916190 -1.003904
C -0.533299 0.433931 0.113237
C -1.632157 -0.328964 -0.125986
C -3.060113 0.145678 0.024560
H 2.202487 -1.713583 -0.334391
H 0.618674 -2.136988 0.381755
H 0.732057 -1.722523 -1.356910
H 1.552700 1.975909 -0.721500
H 1.290076 0.773542 -2.028372
H 2.753371 0.678276 -0.985731
H -0.661562 1.476287 0.444794
H -1.503030 -1.368677 -0.461052
H 1.084645 -0.166155 2.012924
H -3.607778 0.073984 -0.935574
H -3.614265 -0.478717 0.752671
H -3.104711 1.194318 0.367116


