%chk=000062852.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062852

0 1
 O   -2.219700     -0.8079000     -0.3254000    
 O  -0.5604000      0.8324000     -0.3507000    
 O   -5.197500       2.019200     -0.4061000    
 O   -5.811600     -0.6938000      0.3801000    
 O   -2.476900       2.752100      0.4553000    
 O   -2.649500      -3.490800      9.0700001E-02
 C   -4.258000       1.141500      0.2165000    
 C   -4.584500     -0.2869000     -0.2196000    
 C   -2.840500       1.536400     -0.1981000    
 C   -3.472200      -1.250600      0.2002000    
 C   -1.826900      0.4609000      0.1926000    
 C   -3.718800      -2.661200     -0.3255000    
 C   0.5071000      0.1730000      0.3159000    
 C    1.824800      0.6270000     -0.2963000    
 C    3.019700     -5.7999998E-02  0.3655000    
 C    4.340400      0.4361000     -0.2289000    
 C    5.572900     -0.2358000      0.3832000    
 C    6.889300      0.2036000     -0.2616000    
 C    8.077500     -0.5506000      0.3374000    
 C    9.384900     -0.1465000     -0.3252000    
 H   -4.398000       1.261800       1.297100    
 H   -4.726200     -0.3169000      -1.306900    
 H   -2.796000       1.731500      -1.276200    
 H   -3.390800      -1.306300       1.294400    
 H   -1.747800      0.4068000       1.287600    
 H   -4.655400      -3.075400      5.9700001E-02
 H   -3.741600      -2.671000      -1.420300    
 H   0.4901000      0.4261000       1.382600    
 H   0.3960000     -0.9121000      0.2075000    
 H    1.816900      0.4188000      -1.373400    
 H    1.910700       1.716800     -0.2019000    
 H    3.009800      0.1396000       1.444100    
 H    2.940900      -1.144000      0.2342000    
 H   -5.085600       1.948000      -1.369400    
 H   -5.692300     -0.6837000       1.345100    
 H    4.336200      0.2548000      -1.311100    
 H    4.419200       1.521600     -9.0599999E-02
 H   -2.509800       2.600100       1.415200    
 H    5.469400      -1.323500      0.2823000    
 H    5.604100     -1.9800000E-02   1.458300    
 H    7.024500       1.282800     -0.1220000    
 H    6.845600      1.9900000E-02  -1.341900    
 H   -2.824800      -4.381500     -0.2578000    
 H    7.933800      -1.630500      0.2156000    
 H    8.140800     -0.3506000       1.413300    
 H    9.575200      0.9238000     -0.1966000    
 H    9.365700     -0.3659000      -1.397500    
 H    10.22070     -0.6960000      0.1191000    


%chk=000062852-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062852

0 1
O -2.251192 -0.789375 -0.246795
O -0.549210 0.827208 -0.188668
O -5.185631 2.248094 -0.185765
O -5.970664 -0.519673 0.357487
O -2.511011 2.843205 0.570568
O -3.131949 -3.561237 0.698961
C -4.275972 1.180213 0.270306
C -4.654091 -0.225452 -0.220355
C -2.830711 1.589107 -0.105191
C -3.561909 -1.229282 0.257110
C -1.826084 0.518864 0.338479
C -3.763018 -2.651257 -0.262328
C 0.556962 0.027524 0.392364
C 1.862718 0.577633 -0.183130
C 3.102773 -0.180255 0.344005
C 4.428708 0.384261 -0.213885
C 5.676381 -0.378721 0.285080
C 7.003035 0.197084 -0.259455
C 8.251059 -0.577466 0.222527
C 9.572161 0.009244 -0.320307
H -4.378687 1.202376 1.371087
H -4.690345 -0.246381 -1.336015
H -2.747877 1.694889 -1.209222
H -3.576416 -1.254889 1.369217
H -1.812721 0.417886 1.450677
H -4.848318 -2.888758 -0.346593
H -3.302147 -2.722508 -1.268586
H 0.533629 0.130407 1.499268
H 0.412249 -1.038752 0.130691
H 1.820440 0.509825 -1.287394
H 1.937794 1.652790 0.069206
H 3.125383 -0.133291 1.452999
H 3.022886 -1.255383 0.078700
H -5.471111 2.063730 -1.116465
H -6.283771 -1.402943 0.035657
H 4.400486 0.355153 -1.323134
H 4.516241 1.454665 0.066203
H -3.289146 3.445261 0.424692
H 5.593611 -1.446890 -0.006793
H 5.698199 -0.361137 1.395020
H 7.093994 1.261143 0.044226
H 6.977317 0.192913 -1.369450
H -2.913802 -4.419267 0.257934
H 8.161763 -1.639248 -0.086230
H 8.273536 -0.577751 1.331607
H 9.702727 1.058694 0.005218
H 9.585252 -0.001423 -1.426697
H 10.447882 -0.565525 0.033672


