%chk=000012580.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000012580

0 1
 O    3.603500      8.8999998E-03  0.4005000    
 C   -1.938100     -1.0800000E-02 -0.6589000    
 C   -2.776500     -1.0700000E-02  0.6271000    
 C  -0.4736000     -5.5999998E-03 -0.3785000    
 C   0.2080000       1.204700     -0.2507000    
 C   0.2150000      -1.211300     -0.2448000    
 C   -4.268100      1.8600000E-02  0.3337000    
 C    1.578100       1.209200      1.0600000E-02
 C    1.585100      -1.206600      1.6700000E-02
 C    2.266700      3.5999999E-03  0.1444000    
 H   -2.199300      0.8616000      -1.272000    
 H   -2.196200     -0.8858000      -1.269700    
 H   -2.545400     -0.9012000       1.224300    
 H   -2.517500      0.8590000       1.243400    
 H  -0.3175000       2.150800     -0.3509000    
 H  -0.3049000      -2.160900     -0.3404000    
 H   -4.539000      0.9178000     -0.2287000    
 H   -4.569300     -0.8565000     -0.2508000    
 H   -4.838700      1.6700000E-02   1.267600    
 H    2.097300       2.158800      0.1085000    
 H    2.116000      -2.149000      0.1206000    
 H    3.909800      0.9304000      0.4573000    


%chk=000012580-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000012580

0 1
O 3.686496 -0.050576 0.441522
C -1.980593 0.003313 -0.681555
C -2.819527 0.001040 0.627274
C -0.481675 0.010144 -0.421001
C 0.231971 1.227181 -0.279852
C 0.241678 -1.202018 -0.265235
C -4.339024 -0.008147 0.356942
C 1.614734 1.242670 0.006979
C 1.621900 -1.209083 0.021321
C 2.308920 0.018344 0.158562
H -2.266935 0.889967 -1.281907
H -2.258321 -0.888103 -1.278783
H -2.538196 -0.882361 1.234120
H -2.548340 0.890051 1.230624
H -0.298662 2.179884 -0.400236
H -0.283316 -2.159324 -0.374744
H -4.645854 0.882829 -0.223369
H -4.634890 -0.903312 -0.222530
H -4.914224 -0.011358 1.300979
H 2.147156 2.198298 0.106749
H 2.178111 -2.144289 0.136104
H 4.073992 0.856548 0.517336


