%chk=000081231.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081231

0 1
 O    1.223900     -0.2725000      4.8000002E-03
 O    3.311400      0.7104000      6.0000003E-04
 C  -0.9045000      0.8381000     -1.6200000E-02
 C   -1.355500      6.4599998E-02  -1.261700    
 C   -1.368700      0.1295000       1.262600    
 C   -3.329500     -0.8800000      1.5500000E-02
 C   0.6123000       1.018100     -1.2800000E-02
 C   -2.864800     -0.1719000      -1.263600    
 C   -2.878000     -0.1067000       1.260900    
 C   -4.846400      -1.058700      1.2500000E-02
 C    1.067400       1.788300       1.226200    
 C    1.072200       1.727400      -1.284900    
 C    2.591400     -0.2786000      9.8000001E-03
 C    3.076500      -1.709100      2.9400000E-02
 C    4.592500      -1.798800      1.6899999E-02
 H   -1.382400       1.828000     -4.3499999E-02
 H  -0.8489000     -0.9068000      -1.320100    
 H   -1.106800      0.6108000      -2.177700    
 H   -1.128400      0.7223000       2.151700    
 H  -0.8621000     -0.8371000       1.375500    
 H   -2.872300      -1.878200      4.3699998E-02
 H   -3.380900      0.7913000      -1.366200    
 H   -3.135500     -0.7712000      -2.141200    
 H   -3.158000     -0.6599000       2.165500    
 H   -3.394700      0.8606000       1.308200    
 H   -5.167200      -1.638600     -0.8593000    
 H   -5.176100      -1.592900      0.9098000    
 H   -5.361800     -9.2600003E-02 -1.5000000E-02
 H    2.049400       2.258900       1.118700    
 H   0.3795000       2.613400       1.447100    
 H    1.128100       1.143600       2.110400    
 H    1.136700       1.043900      -2.139400    
 H    2.053700       2.203200      -1.195800    
 H   0.3864000       2.542200      -1.547000    
 H    2.691300      -2.192700      0.9332000    
 H    2.676100      -2.222500     -0.8511000    
 H    5.023100      -1.297800      0.8903000    
 H    4.912700      -2.845100      3.0099999E-02
 H    5.006900      -1.324700     -0.8790000    


%chk=000081231-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000081231

0 1
O 1.297830 -0.156645 0.005311
O 3.503060 0.651393 -0.015513
C -0.896288 0.879151 -0.018489
C -1.349716 0.089746 -1.276674
C -1.349514 0.129836 1.264167
C -3.315184 -0.954618 0.010961
C 0.631583 1.218381 -0.024177
C -2.869519 -0.197881 -1.263796
C -2.869362 -0.157921 1.261157
C -4.835395 -1.219337 0.015573
C 1.055594 2.013245 1.230765
C 1.058735 1.960461 -1.309981
C 2.683388 -0.296831 0.009701
C 3.044795 -1.779063 0.053068
C 4.563402 -2.025490 0.028325
H -1.411253 1.866423 -0.034037
H -0.788498 -0.864536 -1.314595
H -1.098727 0.650760 -2.196175
H -1.097504 0.719384 2.165403
H -0.788966 -0.823127 1.331716
H -2.786404 -1.933116 0.026411
H -3.428277 0.761465 -1.319455
H -3.147280 -0.779535 -2.165531
H -3.146570 -0.710885 2.180933
H -3.428546 0.802457 1.286788
H -5.145320 -1.806451 -0.869576
H -5.144531 -1.778407 0.918970
H -5.398385 -0.265530 0.000972
H 2.105634 2.334510 1.150159
H 0.415421 2.909609 1.330056
H 0.946235 1.410577 2.147577
H 0.952930 1.319894 -2.201152
H 2.108395 2.285283 -1.239494
H 0.418301 2.851363 -1.449009
H 2.584274 -2.211966 0.962201
H 2.543032 -2.276052 -0.799292
H 5.057412 -1.536351 0.885142
H 4.777577 -3.108316 0.070121
H 5.016642 -1.613681 -0.889633


