%chk=000163694.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163694

0 1
 O   -1.542600       2.751900       1.531900    
 O   0.2026000       3.344700      -1.512700    
 C  -0.3726000      7.7399999E-02 -3.4899998E-02
 C   -1.410000      0.9151000      4.3900002E-02
 C    1.000700      0.5083000      1.0000000E-03
 C   -1.257600       2.391800      0.1784000    
 C   0.1875000       2.895700     -0.1537000    
 C    1.301200       1.872800     -1.3000000E-03
 C  -0.7844000      -1.302900     -8.1600003E-02
 C    1.968100     -0.5144000      2.6900001E-02
 C   -2.616100      7.5800002E-02 -3.8000001E-03
 C   -2.243000      -1.294400     -8.5100003E-02
 C    1.587000      -1.890500     -1.0500000E-02
 C   0.1433000      -2.273900     -7.5900003E-02
 C    3.321200     -0.1356000      8.3200000E-02
 C    2.648200       2.229600      5.2000001E-02
 C    3.644500       1.239400      0.1022000    
 C   -3.950700      0.4390000      2.2500001E-02
 C   -3.184700      -2.303100     -0.1408000    
 C    2.580000      -2.870900      1.7400000E-02
 C    4.293300      -1.148300      0.1120000    
 C    3.924800      -2.498200      7.9700001E-02
 C   -4.909400     -0.5777000     -3.5000000E-02
 C   -4.531000      -1.931500     -0.1160000    
 H   -1.989400       2.904900     -0.4553000    
 H   0.4269000       3.759600      0.4795000    
 H  -0.1175000      -3.325800     -9.4099998E-02
 H    2.940200       3.276500      4.1400000E-02
 H    4.686300       1.553100      0.1417000    
 H   -4.256300       1.477700      8.5600004E-02
 H   -2.900600      -3.347600     -0.2010000    
 H    2.323600      -3.926900     -8.1000002E-03
 H  -0.8726000       2.336700       2.102100    
 H    5.350500     -0.8949000      0.1569000    
 H  -0.4248000       4.084400      -1.582800    
 H    4.694500      -3.265100      0.1016000    
 H   -5.965500     -0.3202000     -1.6400000E-02
 H   -5.300400      -2.698200     -0.1584000    


%chk=000163694-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163694

0 1
O -1.581430 2.857308 1.587915
O 0.296828 3.341167 -1.577025
C -0.372264 0.102049 -0.016711
C -1.465816 0.952700 0.027488
C 1.004155 0.501310 0.006953
C -1.246291 2.428400 0.196799
C 0.216020 2.902964 -0.160376
C 1.332089 1.872853 -0.010938
C -0.784098 -1.299432 -0.062493
C 2.002427 -0.521720 0.031105
C -2.676685 0.115326 -0.007998
C -2.263853 -1.273906 -0.071139
C 1.607900 -1.916044 -0.000309
C 0.188730 -2.282094 -0.052422
C 3.388144 -0.140105 0.068004
C 2.706523 2.240345 0.035195
C 3.711130 1.259927 0.078984
C -4.046798 0.447309 0.016151
C -3.224478 -2.298924 -0.119559
C 2.626062 -2.895358 0.015656
C 4.382216 -1.174981 0.087978
C 4.000701 -2.523443 0.062770
C -5.004790 -0.596919 -0.036006
C -4.601558 -1.953730 -0.104568
H -1.943660 3.027196 -0.419224
H 0.404886 3.769837 0.509340
H -0.065244 -3.349122 -0.072534
H 2.979764 3.301137 0.015172
H 4.765515 1.558340 0.110067
H -4.369227 1.492020 0.080929
H -2.924050 -3.351842 -0.169149
H 2.354403 -3.957307 -0.011382
H -1.306662 2.133821 2.208842
H 5.443104 -0.900305 0.119524
H -0.272015 4.147595 -1.686393
H 4.766886 -3.305936 0.075734
H -6.073089 -0.353129 -0.020174
H -5.360278 -2.743007 -0.143704


