%chk=000085703.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085703

0 1
 O    2.209300      0.4464000     -0.8806000    
 O    4.205200       1.438800     -0.3402000    
 C    1.302800     -0.4700000     -0.2411000    
 C    1.566500     -0.2707000       1.243100    
 C  -0.1259000     -9.6600004E-02 -0.6231000    
 C    3.036500      7.9899997E-02   1.287900    
 C    1.629000      -1.889500     -0.7111000    
 C   -1.145800     -0.9738000      0.1032000    
 C    3.244200      0.7487000     -3.7799999E-02
 C   -2.549000     -0.6206000     -0.2957000    
 C   -3.479700     -0.1797000      0.5635000    
 C   -4.885200      0.1626000      0.1669000    
 C   -5.008000       1.624300     -0.2348000    
 H    1.323600      -1.140600       1.861200    
 H   0.9952000      0.5833000       1.630100    
 H  -0.3074000      0.9628000     -0.3945000    
 H  -0.2530000     -0.1788000      -1.711200    
 H    3.667800     -0.8111000       1.344000    
 H    3.260000      0.7623000       2.111200    
 H    2.701600      -2.097700     -0.6224000    
 H    1.097300      -2.655900     -0.1400000    
 H    1.387800      -2.013000      -1.773100    
 H   -1.001800      -2.030100     -0.1467000    
 H   -1.030700     -0.8835000       1.189100    
 H   -2.811400     -0.7540000      -1.342400    
 H   -3.220500     -3.9600000E-02   1.609800    
 H   -5.556500     -5.3800002E-02   1.005600    
 H   -5.211400     -0.4714000     -0.6663000    
 H   -6.043800       1.856100     -0.5029000    
 H   -4.376400       1.854300      -1.099600    
 H   -4.715500       2.286600      0.5871000    


%chk=000085703-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085703

0 1
O 2.266860 0.288275 -1.007299
O 4.211547 1.501338 -0.630157
C 1.346342 -0.630495 -0.213506
C 1.647361 -0.245139 1.268167
C -0.081108 -0.279287 -0.674124
C 3.107522 0.254239 1.241302
C 1.763393 -2.071716 -0.555079
C -1.196180 -1.047668 0.087103
C 3.307085 0.773190 -0.189357
C -2.580102 -0.660709 -0.395250
C -3.558976 -0.127790 0.381728
C -4.940238 0.268353 -0.098735
C -5.237992 1.773938 0.124250
H 1.493705 -1.097679 1.949842
H 0.973686 0.572598 1.582343
H -0.232935 0.808770 -0.543195
H -0.165494 -0.484714 -1.758882
H 3.836571 -0.558108 1.418960
H 3.326715 1.055723 1.963892
H 2.804155 -2.270466 -0.242390
H 1.109000 -2.801924 -0.046839
H 1.696722 -2.238210 -1.643872
H -1.050478 -2.138157 -0.058484
H -1.118451 -0.854642 1.174915
H -2.782648 -0.829154 -1.465618
H -3.351424 0.049717 1.450400
H -5.704342 -0.327316 0.442894
H -5.046875 0.020028 -1.172181
H -6.264000 2.027273 -0.200158
H -4.530034 2.402802 -0.444762
H -5.144589 2.042630 1.193293


