%chk=000072506.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072506

0 1
 O   -1.373000       3.805700      0.7063000    
 O   -3.410500       3.089400     -7.4800000E-02
 O   -3.681800      -3.123400     -4.7800001E-02
 O   -1.865300      -3.131300       2.056000    
 O    3.875100     -0.9892000      -1.828200    
 O    5.435100     -0.8411000      0.4677000    
 C  -6.3999998E-03   2.303500     -0.4624000    
 C   -1.339200       2.417100      -1.182300    
 C   0.1075000       1.092300      0.5182000    
 C   -1.880900       1.101400      -1.709200    
 C  -8.2000000E-03   3.621000      0.3033000    
 C  -0.9175000     -1.9300001E-02  0.3431000    
 C   -1.858800     -4.9999999E-03 -0.6955000    
 C   -2.192200       3.106200     -0.1432000    
 C    1.543400      0.5708000      0.5014000    
 C  -0.9478000      -1.079500       1.269700    
 C   -2.772800      -1.064100     -0.8214000    
 C    2.060400      2.4499999E-02 -0.6664000    
 C    2.314800      0.6482000       1.653800    
 C   -1.869300      -2.118700       1.145400    
 C   -2.779200      -2.113800      9.4999999E-02
 C    3.371100     -0.4523000     -0.6820000    
 C    3.625500      0.1712000       1.638200    
 C    4.153600     -0.3791000      0.4703000    
 C   -3.283100      -4.243100     -0.8365000    
 C    3.699700      -2.391700      -2.018600    
 H   0.8137000       2.308000      -1.189500    
 H   -1.255400       3.124500      -2.018800    
 H  -9.4300002E-02   1.474600       1.530500    
 H   -1.280400      0.7803000      -2.569600    
 H   -2.907500       1.253800      -2.065300    
 H   0.6402000       3.614700       1.184600    
 H   0.2776000       4.467100     -0.3320000    
 H  -0.2448000      -1.096500       2.100100    
 H   -3.489800      -1.065200      -1.639900    
 H    1.456600     -4.1099999E-02  -1.567900    
 H    1.916800       1.074300       2.570200    
 H    4.224200      0.2345000       2.543000    
 H   -2.590200      -3.743300       1.841200    
 H   -4.094300      -4.976100     -0.8253000    
 H   -2.383800      -4.709800     -0.4223000    
 H   -3.103300      -3.935700      -1.871600    
 H    5.821200     -0.7091000       1.350600    
 H    2.634900      -2.642900      -2.057500    
 H    4.189400      -2.953900      -1.217400    
 H    4.159300      -2.668300      -2.971400    


%chk=000072506-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000072506

0 1
O -0.451857 4.144424 -0.426389
O -2.763556 4.335918 -0.442824
O -3.509757 -3.704143 -0.479057
O -0.966815 -4.122206 0.254993
O 4.315165 -0.927101 -1.356123
O 5.608704 -0.302146 1.150159
C -0.195116 1.759637 -0.924259
C -1.679582 2.184740 -1.120661
C -0.010057 0.814721 0.313131
C -2.716622 1.310687 -0.350671
C 0.561243 3.110198 -0.797927
C -0.926288 -0.401708 0.113469
C -2.273309 -0.136332 -0.258186
C -1.750665 3.646841 -0.650204
C 1.461085 0.490450 0.555502
C -0.498378 -1.738900 0.286398
C -3.175622 -1.206145 -0.472664
C 2.254328 -0.119072 -0.448584
C 2.075343 0.803460 1.791130
C -1.395423 -2.800485 0.080802
C -2.738385 -2.533341 -0.305639
C 3.623125 -0.401611 -0.254712
C 3.443518 0.527688 2.006621
C 4.229136 -0.059518 0.991080
C -4.909150 -3.541161 -0.873484
C 5.208903 -2.085112 -1.134865
H 0.167301 1.213438 -1.811583
H -1.931486 2.168485 -2.198087
H -0.376778 1.372661 1.203609
H -3.707728 1.405118 -0.825911
H -2.828584 1.727191 0.671133
H 1.323341 3.112329 -0.003213
H 1.019047 3.429979 -1.749813
H 0.527577 -1.974018 0.580663
H -4.209173 -0.987466 -0.761001
H 1.825543 -0.405364 -1.415013
H 1.485949 1.263384 2.592397
H 3.908075 0.786269 2.967751
H -1.734957 -4.725060 0.068818
H -5.313809 -4.560716 -0.952709
H -4.987223 -3.029463 -1.851958
H -5.472265 -2.972414 -0.108833
H 5.914360 0.016720 2.035449
H 4.636188 -2.937351 -0.721141
H 6.038546 -1.823520 -0.459284
H 5.586409 -2.340382 -2.136509


