%chk=000102917.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102917

0 1
 O   -2.894000      -3.682800      0.2932000    
 O   -3.958200     -0.1976000      0.2209000    
 O   -5.627100       1.911300     -0.5412000    
 O   -3.697900       3.898700     -0.6699000    
 C    1.740100     -0.9607000      0.1665000    
 C   0.5515000      -1.197100     -0.7679000    
 C    2.958800     -0.4518000     -0.6069000    
 C  -0.7224000      -1.636700     -3.7700001E-02
 C    4.159000     -0.2443000      0.3185000    
 C   -1.903300      -1.895600     -0.9821000    
 C    5.367400      0.2958000     -0.4499000    
 C   -3.168900      -2.405100     -0.2812000    
 C    6.576500      0.4716000      0.4717000    
 C   -3.680300      -1.466000      0.8067000    
 C    7.823200      0.9807000     -0.2552000    
 C   -4.455400      0.7202000       1.183600    
 C    9.034800       1.133200      0.6514000    
 C   -4.694900       2.076400      0.5300000    
 C   -3.408800       2.649800     -5.0400000E-02
 H    1.990000      -1.895300      0.6827000    
 H    1.462500     -0.2298000      0.9357000    
 H   0.8226000      -1.959500      -1.508800    
 H   0.3393000     -0.2760000      -1.325100    
 H    3.222400      -1.170000      -1.392900    
 H    2.709000      0.4939000      -1.103300    
 H  -0.9873000     -0.8551000      0.6831000    
 H  -0.5058000      -2.544500      0.5380000    
 H    4.421000      -1.196000      0.7966000    
 H    3.890900      0.4566000       1.118400    
 H   -2.131500     -0.9756000      -1.533800    
 H   -1.589700      -2.640700      -1.724600    
 H    5.625300     -0.3943000      -1.262300    
 H    5.113900       1.258300     -0.9103000    
 H   -3.952100      -2.538500      -1.037100    
 H    6.809700     -0.4887000      0.9486000    
 H    6.320000       1.170700       1.277300    
 H   -4.598200      -1.882700       1.240100    
 H   -2.958600      -1.368600       1.625800    
 H    7.602500       1.949700     -0.7184000    
 H    8.076300      0.2903000      -1.068600    
 H   -2.610400      -4.273300     -0.4254000    
 H   -5.404200      0.3340000       1.574600    
 H   -3.743400      0.8216000       2.010900    
 H    9.308300      0.1738000       1.101700    
 H    8.831400       1.845500       1.457300    
 H    9.893600       1.499600      8.0499999E-02
 H   -5.140000       2.778700       1.242200    
 H   -2.661400       2.811100      0.7327000    
 H   -2.987800       1.996900     -0.8221000    
 H   -5.255700       1.260000      -1.160900    
 H   -2.859800       4.241100      -1.025000    


%chk=000102917-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102917

0 1
O -2.877097 -3.643531 0.201004
O -3.997417 -0.152966 0.230537
O -5.769124 1.717479 -0.681129
O -4.155594 3.984686 -0.747543
C 1.789424 -0.790975 0.132453
C 0.617742 -1.113919 -0.821580
C 3.114900 -0.500070 -0.606765
C -0.696213 -1.457493 -0.084812
C 4.286132 -0.159207 0.341758
C -1.864474 -1.724607 -1.059173
C 5.616580 0.103003 -0.399572
C -3.132169 -2.323175 -0.415242
C 6.787553 0.455760 0.544975
C -3.704733 -1.496971 0.743843
C 8.119461 0.706918 -0.198469
C -4.593362 0.731684 1.245862
C 9.283590 1.063659 0.750966
C -4.950603 2.030122 0.512946
C -3.721262 2.846219 0.060673
H 1.938698 -1.641212 0.830726
H 1.520205 0.083406 0.761219
H 0.903635 -1.966295 -1.473789
H 0.447782 -0.249988 -1.498178
H 3.389425 -1.380815 -1.224727
H 2.962084 0.340427 -1.316000
H -0.961634 -0.619494 0.590603
H -0.539444 -2.348120 0.556425
H 4.427557 -0.990983 1.063679
H 4.020762 0.733611 0.945878
H -2.150150 -0.782012 -1.565656
H -1.524657 -2.419238 -1.858198
H 5.885404 -0.793743 -0.996669
H 5.473082 0.928472 -1.128291
H -3.914809 -2.420170 -1.199718
H 6.928804 -0.365650 1.278814
H 6.523858 1.357468 1.136666
H -4.630747 -1.977504 1.121676
H -2.971208 -1.443200 1.573609
H 7.976835 1.525167 -0.933837
H 8.383167 -0.195823 -0.786804
H -2.499819 -4.244879 -0.489261
H -5.506956 0.259260 1.664067
H -3.871906 0.919260 2.069879
H 9.469515 0.247657 1.474985
H 9.055738 1.978516 1.330199
H 10.222196 1.241228 0.194184
H -5.597515 2.662701 1.145785
H -3.190791 3.272544 0.930325
H -3.025512 2.188693 -0.503367
H -5.379242 0.885344 -1.066105
H -4.864794 3.631958 -1.351150


