%chk=000005057.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005057

0 1
 O   -7.111600     -0.7606000      0.6055000    
 O   -9.207800     -0.1870000     -0.1854000    
 C    5.750100      0.5037000      0.8448000    
 C    6.834200     -0.5476000       1.208600    
 C    7.223500      -1.406900      1.9200001E-02
 C    4.624200     -0.1144000     -1.7100001E-02
 C    6.009000      -2.163900     -0.4966000    
 C    4.744300      -1.335200     -0.5973000    
 C    6.415600       1.664600      7.0100002E-02
 C    5.218700       1.051900       2.191800    
 C    3.438200      0.7090000     -0.1871000    
 C    3.678300      -2.036100      -1.407800    
 C    2.192100      0.2098000     -0.1874000    
 C   0.9450000      0.9651000     -0.3505000    
 C    1.063400       2.457400     -0.5370000    
 C  -0.2218000      0.2853000     -0.3232000    
 C   -1.564100      0.8182000     -0.4641000    
 C   -2.659500      3.9600000E-02 -0.4201000    
 C   -4.052800      0.4772000     -0.5515000    
 C   -5.028500     -0.4528000     -0.4812000    
 C   -4.304100       1.947600     -0.7613000    
 C   -6.509600     -0.2616000     -0.5832000    
 C   -8.470900     -0.6587000      0.6688000    
 C   -9.005800      -1.204500       1.942200    
 H    6.464900      -1.206700       2.006900    
 H    7.728400     -5.4299999E-02   1.610200    
 H    8.003700      -2.119700      0.3105000    
 H    7.648700     -0.7875000     -0.7789000    
 H    5.805700      -3.017200      0.1632000    
 H    6.269900      -2.576500      -1.478900    
 H    7.294400       2.042300      0.6056000    
 H    6.743500       1.353000     -0.9277000    
 H    5.735700       2.513800     -5.9400000E-02
 H    6.040800       1.410500       2.822300    
 H    4.533000       1.894800       2.049700    
 H    4.681800      0.2769000       2.751100    
 H    3.609400       1.768100     -0.3475000    
 H    3.061800      -2.674600     -0.7677000    
 H    3.052700      -1.354300      -1.989200    
 H    4.137700      -2.688700      -2.160200    
 H    2.037800     -0.8423000      3.8600001E-02
 H   0.1037000       2.967000     -0.6433000    
 H    1.563800       2.913100      0.3250000    
 H    1.640300       2.686200      -1.440100    
 H  -0.1869000     -0.7959000     -0.1825000    
 H   -1.668500       1.886200     -0.6099000    
 H   -2.519200      -1.031400     -0.2718000    
 H   -4.740400      -1.494600     -0.3347000    
 H   -3.814300       2.293500      -1.678500    
 H   -5.360000       2.206000     -0.8574000    
 H   -3.916500       2.527200      8.4100001E-02
 H   -6.801500      0.7813000     -0.7224000    
 H   -6.875600     -0.8389000      -1.440600    
 H   -8.594000     -0.6459000       2.786500    
 H   -8.753100      -2.264500       2.026000    
 H   -10.09510      -1.105500       1.959500    


%chk=000005057-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005057

0 1
O -7.415754 0.163070 0.366450
O -7.557573 -2.164004 0.473834
C 5.612059 0.422293 0.959704
C 6.751637 -0.572116 1.328723
C 7.306352 -1.321615 0.106725
C 4.580929 -0.239371 -0.002882
C 6.182814 -2.153889 -0.538654
C 4.862915 -1.402737 -0.696227
C 6.222195 1.690639 0.287887
C 4.919289 0.841660 2.289408
C 3.322302 0.517341 -0.148143
C 3.915193 -2.048659 -1.694728
C 2.040004 0.027149 -0.281278
C 0.829738 0.836392 -0.400532
C 0.963920 2.349147 -0.422377
C -0.395836 0.181982 -0.487233
C -1.707343 0.774682 -0.600795
C -2.872284 0.033036 -0.677175
C -4.227661 0.570916 -0.789977
C -5.282931 -0.317545 -0.859523
C -4.405285 2.080208 -0.819653
C -6.734855 0.029133 -0.991195
C -7.754476 -1.039278 0.990573
C -8.355318 -0.777738 2.356736
H 6.358436 -1.314464 2.053690
H 7.555570 -0.012082 1.846497
H 8.146446 -1.978838 0.402298
H 7.708298 -0.601028 -0.631510
H 5.998926 -3.066950 0.070980
H 6.504354 -2.525159 -1.532657
H 6.913697 2.197705 0.987778
H 6.782379 1.431731 -0.628032
H 5.441398 2.420240 0.004903
H 5.674512 1.225467 3.002134
H 4.164092 1.633128 2.137884
H 4.411920 -0.022055 2.756898
H 3.429360 1.610159 -0.082229
H 3.338205 -2.877362 -1.234781
H 3.187742 -1.332244 -2.110763
H 4.487492 -2.492684 -2.531409
H 1.883118 -1.059616 -0.258447
H -0.005855 2.858557 -0.528321
H 1.434512 2.715884 0.510313
H 1.609098 2.675349 -1.260147
H -0.372888 -0.919209 -0.463511
H -1.780347 1.869292 -0.625308
H -2.789589 -1.064415 -0.652615
H -5.064779 -1.391690 -0.793256
H -3.880186 2.524518 -1.686277
H -5.463431 2.378718 -0.868003
H -3.976474 2.536808 0.092102
H -6.918860 1.015670 -1.441454
H -7.277762 -0.755355 -1.545874
H -8.970105 0.136003 2.348617
H -7.541050 -0.630286 3.089680
H -8.955567 -1.644986 2.669853


