%chk=000158096.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158096

0 1
 O   -1.992900       1.061400      0.8317000    
 O    1.001200       1.831200      -1.157600    
 O   -1.150600       2.371900      -2.973900    
 O   -3.486000       3.371300      -1.607100    
 O   -4.298800       1.616000       2.205300    
 O    2.429300      -1.786700      -1.601800    
 O   0.7834000      -3.777100      -1.665600    
 O    4.601800     -0.5996000     -0.8983000    
 O    5.720300       1.387600      0.5979000    
 O   -4.285900      -2.924600      0.1124000    
 C  -0.6104000       1.337300      0.5918000    
 C   0.1922000      0.2151000       1.242500    
 C  -0.3473000       1.439900     -0.9144000    
 C   -1.267200       2.480400      -1.553700    
 C   -2.725600       2.255500      -1.151900    
 C   -2.852200       2.106100      0.3678000    
 C  -0.2539000      -1.124200      0.6919000    
 C    1.675000      0.4811000       1.080700    
 C   0.5200000      -1.834500     -0.2342000    
 C   -4.271400       1.745300      0.7953000    
 C    2.453500     -0.2254000      0.1556000    
 C    1.849100      -1.322700     -0.6287000    
 C   -1.493000      -1.658800       1.081500    
 C    2.288600       1.487900       1.844300    
 C   6.0600001E-02  -3.043300     -0.7721000    
 C    3.810200      7.7000000E-02 -1.6200000E-02
 C   -1.949100      -2.866200      0.5513000    
 C   -1.174200      -3.555400     -0.3775000    
 C    3.641700       1.785800       1.679100    
 C    4.400300       1.083200      0.7469000    
 C   -3.268700      -3.415600      0.9768000    
 H  -0.3533000       2.288900       1.078000    
 H  -2.0500001E-02  0.1875000       2.321400    
 H  -0.5180000      0.4845000      -1.422700    
 H  -0.9480000       3.497400      -1.292500    
 H   -3.110800       1.364200      -1.661700    
 H   -2.572400       3.038000      0.8778000    
 H   -4.587700      0.7888000      0.3660000    
 H   -4.988800       2.517700      0.5039000    
 H   -2.100100      -1.148700       1.825800    
 H    1.170700       1.736400      -2.109800    
 H    1.709700       2.053100       2.570900    
 H  -0.2530000       2.652900      -3.218900    
 H   -3.175900       4.160800      -1.131400    
 H   -1.535200      -4.495200     -0.7890000    
 H    4.095500       2.570200       2.278700    
 H   -3.655300      0.9292000       2.450200    
 H   -3.270300      -4.510600      0.9389000    
 H   -3.505500      -3.120700       2.005000    
 H   0.2878000      -4.578100      -1.907100    
 H    4.123900      -1.349400      -1.283600    
 H    6.092800      0.8050000     -8.6599998E-02
 H   -5.127800      -3.300900      0.4206000    


%chk=000158096-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158096

0 1
O -1.965793 1.231854 0.942162
O 0.744757 1.793061 -1.643902
O -1.629425 2.380406 -3.092626
O -3.831035 3.310477 -1.534458
O -4.159980 2.021324 2.564242
O 2.916969 -2.090662 -1.291574
O 1.049674 -3.941691 -1.630123
O 4.842855 -0.638517 -0.659402
O 5.841680 1.416383 0.805910
O -4.104410 -2.289336 1.239806
C -0.578857 1.366062 0.456343
C 0.218886 0.184432 1.129496
C -0.556310 1.377134 -1.095081
C -1.528644 2.437759 -1.630593
C -2.945341 2.234863 -1.087390
C -2.905718 2.273587 0.449645
C -0.181964 -1.174498 0.554250
C 1.710661 0.476000 1.089411
C 0.703332 -1.940228 -0.277756
C -4.247273 1.938376 1.103845
C 2.562644 -0.290656 0.235103
C 2.086171 -1.476775 -0.503708
C -1.480132 -1.647811 0.838006
C 2.264577 1.527290 1.844816
C 0.212229 -3.176835 -0.819820
C 3.950374 0.044427 0.143892
C -1.948758 -2.862431 0.295323
C -1.098854 -3.620101 -0.537753
C 3.643791 1.847713 1.763406
C 4.485312 1.117450 0.908790
C -3.346718 -3.369065 0.604999
H -0.148218 2.325623 0.817931
H -0.120122 0.217624 2.184115
H -0.849436 0.379547 -1.481541
H -1.154988 3.437779 -1.317089
H -3.323029 1.248018 -1.433542
H -2.556984 3.272734 0.788109
H -4.566790 0.924870 0.779621
H -5.000257 2.679411 0.796327
H -2.153940 -1.055814 1.456139
H 1.451544 1.142554 -1.399400
H 1.623567 2.111468 2.514387
H -0.708755 2.447892 -3.455460
H -3.687998 3.413892 -2.511551
H -1.452505 -4.564377 -0.976132
H 4.072475 2.661619 2.355175
H -3.413030 1.430583 2.842060
H -3.835539 -3.700586 -0.336762
H -3.273759 -4.251890 1.278909
H 0.586295 -4.772222 -1.913066
H 4.273694 -1.388386 -1.127728
H 6.252770 0.777112 0.161857
H -4.981897 -2.626543 1.546080


