%chk=000158455.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158455

0 1
 O   -1.139600      -1.318700     -0.4464000    
 O   -3.607200     -2.0099999E-02 -0.1555000    
 O   1.6000001E-02  -3.055200      0.5271000    
 O    1.601700      0.3150000       3.133100    
 O    5.186400       1.139900      -1.930400    
 O  -0.4027000     -0.2442000       2.218600    
 O    5.022900       2.189500      7.9099998E-02
 O   -5.374500      0.6688000      -1.475500    
 C    1.162900      -1.076600     -0.1466000    
 C    1.554500     -0.1763000      0.8443000    
 C    2.680300      0.6248000      0.6533000    
 C    3.414400      0.5261000     -0.5287000    
 C    1.897200      -1.175500      -1.328500    
 C    3.022800     -0.3741000      -1.519700    
 C  -8.5000005E-03  -1.926700      2.2399999E-02
 C   -2.361500      -2.056400     -0.3345000    
 C   -3.495400      -1.225100     -0.9029000    
 C   0.8087000     -4.9600001E-02   2.089800    
 C    4.587600       1.361700     -0.7282000    
 C   -4.592000      0.8359000     -0.5534000    
 C   -4.552300       2.019100      0.3307000    
 C   -5.421700       3.017600      0.1518000    
 H    2.987200       1.340600       1.412500    
 H    1.601400      -1.873300      -2.107800    
 H    3.564900     -0.4834000      -2.454700    
 H   -2.272700      -2.998300     -0.8866000    
 H   -2.546400      -2.263500      0.7258000    
 H   -3.280500     -0.9729000      -1.947900    
 H   -4.434300      -1.786500     -0.8446000    
 H    1.092300      0.3979000       3.967300    
 H    5.976600       1.707800      -2.054800    
 H   -3.811300       2.063300       1.121000    
 H   -6.174000       3.002800     -0.6291000    
 H   -5.391800       3.886200      0.8013000    


%chk=000158455-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158455

0 1
O -1.087956 -1.250562 -0.279473
O -3.715657 0.058933 0.102641
O 0.036924 -3.289261 -0.527183
O 0.853849 1.078004 2.524232
O 5.589150 1.057769 -1.749149
O -0.008962 -1.066938 2.323566
O 5.092881 2.204810 0.210011
O -5.373525 0.708608 -1.410718
C 1.290067 -1.198084 -0.368811
C 1.561394 -0.226864 0.639811
C 2.709320 0.588796 0.529181
C 3.600372 0.428816 -0.557893
C 2.202451 -1.373300 -1.435160
C 3.352159 -0.566375 -1.535979
C 0.049558 -2.047390 -0.371348
C -2.381141 -1.959489 -0.081338
C -3.482184 -1.148518 -0.731701
C 0.714388 -0.150890 1.869007
C 4.794882 1.317528 -0.623156
C -4.711171 0.929816 -0.367310
C -4.833710 2.095862 0.543871
C -5.734847 3.083011 0.303042
H 2.923068 1.340873 1.293404
H 1.995289 -2.140928 -2.186774
H 4.055509 -0.693712 -2.362796
H -2.313483 -2.964523 -0.535822
H -2.529361 -2.054132 1.008553
H -3.214786 -0.838423 -1.756920
H -4.419299 -1.734549 -0.776687
H 0.308025 1.065481 3.355866
H 6.369614 1.674258 -1.745036
H -4.160903 2.111914 1.407268
H -6.390964 3.033224 -0.573888
H -5.829551 3.946832 0.968986


