%chk=000002363.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002363

0 1
 O    1.517000       4.327900     -0.3864000    
 O    1.157200       3.681400       1.787600    
 O    2.832800      -3.007800       1.806400    
 O    4.433000      -2.626800      4.6599999E-02
 O    4.314200     -0.3829000      -1.714200    
 O   -4.552400      0.3747000       1.701200    
 O   -2.514300      -2.172100      -1.805400    
 O   -4.748100      -1.532200     -0.2982000    
 C   0.2536000       2.373600     -7.5400002E-02
 C   0.9417000       2.319800      -1.429100    
 C   0.2012000       1.048900      0.7039000    
 C    2.284300       1.572200      -1.404700    
 C    1.381200      0.1172000      0.4830000    
 C    1.175500       3.799700      -1.678300    
 C    2.323200      0.3385000     -0.5472000    
 C    1.024600       3.494900      0.5891000    
 C   -1.134000      0.3532000      0.4332000    
 C    1.516000      -1.011400       1.318600    
 C    3.385600     -0.5658000     -0.7362000    
 C    2.565200      -1.877900       1.097400    
 C    3.474800      -1.662000      9.4499998E-02
 C   -1.218100     -0.6014000     -0.5721000    
 C   -2.246400      0.6836000       1.196500    
 C   -3.463600      4.8599999E-02  0.9501000    
 C   -2.435400      -1.236400     -0.8185000    
 C    4.017600      -3.479600       1.132900    
 C   -3.558200     -0.9113000     -5.7399999E-02
 C   -5.375200       1.437000       1.222800    
 C   -2.247700      -3.524600      -1.439100    
 C   -5.305500      -1.379100      -1.601300    
 H  -0.7618000       2.780400     -0.1955000    
 H   0.2929000       1.876800      -2.193200    
 H   0.2213000       1.289100       1.777300    
 H    3.086300       2.232600      -1.047400    
 H    2.533500       1.315100      -2.442500    
 H    1.990000       3.995600      -2.382200    
 H   0.2725000       4.310300      -2.030400    
 H   0.8079000      -1.202200       2.119400    
 H  -0.3676000     -0.8570000      -1.197200    
 H   -2.176600       1.431900       1.981700    
 H    4.954400      -1.114600      -1.673900    
 H    4.834000      -3.542900       1.861600    
 H    3.820500      -4.482400      0.7366000    
 H   -6.202100       1.572600       1.925200    
 H   -5.788300       1.193400      0.2391000    
 H   -4.804400       2.369600       1.170000    
 H   -2.957100      -3.865400     -0.6784000    
 H   -1.222400      -3.626000      -1.069200    
 H   -2.362200      -4.149300      -2.329100    
 H   -5.049200      -2.241600      -2.222700    
 H   -4.981600     -0.4507000      -2.084800    
 H   -6.394300      -1.347600      -1.499800    


%chk=000002363-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002363

0 1
O 1.798127 4.362507 -0.613966
O 1.404805 3.829344 1.620278
O 2.868774 -2.960580 2.082771
O 4.489565 -2.749415 0.329318
O 4.433263 -0.501923 -1.683822
O -4.583771 0.917944 1.391710
O -2.526662 -1.997397 -2.046919
O -4.902497 -1.085473 -0.681390
C 0.444469 2.421583 -0.231373
C 1.128834 2.272818 -1.611783
C 0.296988 1.143650 0.630088
C 2.449884 1.472263 -1.523647
C 1.471759 0.173550 0.488709
C 1.422141 3.755435 -1.938173
C 2.429957 0.304627 -0.549948
C 1.246713 3.562679 0.419888
C -1.054912 0.474430 0.319682
C 1.544319 -0.892880 1.436804
C 3.489263 -0.648340 -0.652901
C 2.593976 -1.796574 1.307675
C 3.547442 -1.680307 0.283095
C -1.182035 -0.513986 -0.684982
C -2.210233 0.893220 1.020292
C -3.485663 0.369123 0.706874
C -2.446823 -1.052726 -0.996096
C 4.220730 -3.390061 1.650367
C -3.619450 -0.595253 -0.331350
C -5.525787 -0.027941 2.031050
C -3.035175 -3.331429 -1.650010
C -5.366674 -0.627436 -2.014905
H -0.571750 2.841111 -0.390237
H 0.444424 1.820735 -2.349760
H 0.262180 1.491034 1.683353
H 3.269067 2.155135 -1.215360
H 2.735585 1.111124 -2.528096
H 2.282319 3.913320 -2.607207
H 0.535454 4.294190 -2.319972
H 0.796151 -0.990733 2.227340
H -0.308065 -0.895719 -1.221422
H -2.148275 1.640319 1.819418
H 5.108507 -1.225123 -1.634956
H 4.969999 -3.026063 2.380158
H 4.228586 -4.482141 1.523809
H -6.302353 0.607338 2.483444
H -5.005521 -0.603900 2.820554
H -5.963884 -0.712556 1.286529
H -4.048249 -3.254026 -1.216965
H -2.345827 -3.796844 -0.920298
H -3.054389 -3.923690 -2.577565
H -4.664332 -0.958168 -2.801029
H -5.461808 0.474024 -2.024909
H -6.353647 -1.093217 -2.159266


