%chk=000051859.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051859

0 1
 O    1.707300     -0.2436000     -0.8034000    
 O    4.494100     -8.6999997E-02  -1.229400    
 O    6.170200      3.5900000E-02  0.9761000    
 O   -4.097600      -1.374100       1.495500    
 C  -0.4546000      0.6867000     -0.2596000    
 C   -1.822200      0.4621000      2.7100001E-02
 C   0.3813000     -0.4110000     -0.5220000    
 C   -2.313600     -0.8534000      4.3099999E-02
 C    2.637000     -0.8692000      7.6399997E-02
 C    3.944200     -8.5100003E-02  9.0000004E-02
 C  -0.1238000      -1.711300     -0.5019000    
 C   -1.468800      -1.932000     -0.2198000    
 C   3.6899999E-02   2.002200     -0.2756000    
 C   -2.658000       1.559800      0.2894000    
 C    4.964800     -0.7202000       1.025400    
 C  -0.8079000       3.080900     -1.2600000E-02
 C   -2.152800       2.860100      0.2694000    
 C   -3.710800      -1.164000      0.3318000    
 C   -4.725600      -1.236800     -0.7999000    
 H    2.231500     -0.9230000       1.095000    
 H    2.815700      -1.886900     -0.2907000    
 H    3.773600      0.9640000      0.3561000    
 H   0.5163000      -2.563100     -0.7148000    
 H   -1.848400      -2.950800     -0.2099000    
 H    1.082600       2.209400     -0.4921000    
 H   -3.713900       1.431800      0.5149000    
 H    5.205400      -1.745000      0.7237000    
 H    4.606200     -0.7299000       2.058800    
 H  -0.4154000       4.093500     -2.7899999E-02
 H   -2.809600       3.700500      0.4743000    
 H   -5.144600      -2.245300     -0.8423000    
 H   -4.248000      -1.013400      -1.758000    
 H   -5.515500     -0.5025000     -0.6223000    
 H    3.827100      0.3000000      -1.822100    
 H    6.472700      4.2199999E-02  5.1800001E-02


%chk=000051859-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051859

0 1
O 1.750166 0.103278 0.209285
O 4.282485 0.293916 -1.113758
O 6.574511 -0.360947 0.241252
O -4.095891 -2.572127 0.548172
C -0.552708 0.757994 0.014192
C -1.966457 0.430154 -0.036976
C 0.409545 -0.300224 0.210024
C -2.374214 -0.957384 0.097418
C 2.792500 -0.920972 0.432231
C 4.122837 -0.187902 0.272034
C -0.005828 -1.624031 0.398248
C -1.389078 -1.930913 0.343840
C -0.124334 2.119119 -0.100324
C -2.887949 1.525551 -0.152479
C 5.341714 -1.096598 0.501357
C -1.053546 3.150974 -0.245322
C -2.447310 2.847538 -0.259331
C -3.773968 -1.495587 -0.042839
C -4.794616 -0.834458 -0.971048
H 2.685128 -1.350797 1.448422
H 2.697645 -1.720861 -0.328433
H 4.159753 0.670751 0.974010
H 0.711712 -2.430319 0.569583
H -1.721501 -2.965558 0.476487
H 0.946266 2.335079 -0.050997
H -3.961297 1.331485 -0.127004
H 5.261181 -1.989799 -0.155881
H 5.395481 -1.421738 1.553842
H -0.717801 4.190001 -0.328067
H -3.179282 3.658515 -0.341137
H -5.392557 -1.636956 -1.434615
H -4.333273 -0.211690 -1.753890
H -5.498240 -0.209745 -0.387507
H 3.523908 0.891430 -1.332647
H 6.450820 0.094321 -0.633642


