%chk=000095646.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095646

0 1
 O  -0.1706000       2.444800      0.6683000    
 O   -2.654400     -0.9038000      0.6854000    
 O   -3.809200     -8.5800000E-02  -1.220100    
 C  -0.6030000       1.106600      0.4172000    
 C   0.5013000      0.3969000     -0.3781000    
 C    1.868300      0.4248000      0.3085000    
 C   -1.953300       1.138000     -0.3121000    
 C    2.939500     -0.2261000     -0.5703000    
 C    4.339200     -0.1948000      5.1100001E-02
 C   -2.536900     -0.2569000     -0.5896000    
 C    5.436000     -0.9060000     -0.7449000    
 C    6.790500     -0.8990000     -5.3900000E-02
 C  -0.8380000       2.999100       1.790500    
 C   -2.742700      -2.317400      0.5846000    
 C   -3.704000      0.1839000      -2.611400    
 C   -2.862800      -2.904400       1.974800    
 H  -0.7056000      0.5783000       1.374300    
 H   0.5974000      0.8833000      -1.357600    
 H   0.2249000     -0.6472000     -0.5602000    
 H    2.165200       1.458300      0.5209000    
 H    1.808100     -9.8899998E-02   1.269900    
 H   -2.687600       1.699800      0.2771000    
 H   -1.843500       1.713400      -1.238400    
 H    2.974100      0.2798000      -1.543100    
 H    2.659500      -1.268700     -0.7657000    
 H    4.634600      0.8511000      0.2034000    
 H    4.285900     -0.6482000       1.049400    
 H   -1.871600     -0.8382000      -1.238800    
 H    5.136300      -1.945500     -0.9230000    
 H    5.533500     -0.4309000      -1.728200    
 H    7.533400      -1.418100     -0.6675000    
 H    6.736600      -1.403300      0.9160000    
 H    7.139100      0.1254000      0.1104000    
 H   -1.899800       3.162600       1.592500    
 H  -0.7069000       2.373500       2.679200    
 H  -0.3883000       3.974400       1.998500    
 H   -1.843300      -2.710000      9.7499996E-02
 H   -3.619000      -2.591100     -1.3000000E-02
 H   -4.715100      0.2110000      -3.027300    
 H   -3.146500     -0.6090000      -3.119500    
 H   -3.237600       1.154200      -2.797600    
 H   -1.997800      -2.626900       2.586200    
 H   -3.750300      -2.513000       2.483000    
 H   -2.931400      -3.995000       1.934200    


%chk=000095646-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095646

0 1
O -0.126521 2.463648 0.745362
O -2.703781 -0.883651 0.737353
O -3.805461 -0.207288 -1.234134
C -0.512910 1.084450 0.367837
C 0.631327 0.567716 -0.522646
C 1.963658 0.389174 0.236612
C -1.889156 1.094749 -0.339858
C 3.127176 -0.052103 -0.678659
C 4.459272 -0.246980 0.080217
C -2.492627 -0.298164 -0.557118
C 5.628963 -0.675800 -0.834888
C 6.955974 -0.868588 -0.069288
C -0.789997 2.955688 1.950695
C -3.204851 -2.276210 0.694399
C -3.707076 -0.194880 -2.693705
C -3.308056 -2.762799 2.138439
H -0.589717 0.463093 1.287696
H 0.769068 1.288788 -1.353830
H 0.332359 -0.398904 -0.977285
H 2.216638 1.346588 0.730670
H 1.827396 -0.361151 1.044152
H -2.622477 1.661334 0.262163
H -1.790413 1.606531 -1.316105
H 3.269582 0.705049 -1.478218
H 2.857747 -0.999474 -1.192790
H 4.727168 0.697880 0.597704
H 4.320685 -1.007867 0.877024
H -1.836836 -0.956121 -1.184020
H 5.358917 -1.618882 -1.353190
H 5.766598 0.086050 -1.629467
H 7.775891 -1.171526 -0.746532
H 6.854876 -1.648384 0.709263
H 7.261856 0.068150 0.434023
H -1.883346 3.086940 1.811639
H -0.622851 2.272561 2.810660
H -0.336889 3.936685 2.167886
H -2.493449 -2.899053 0.107172
H -4.186380 -2.288124 0.185435
H -4.742152 -0.228991 -3.068569
H -3.148896 -1.078004 -3.073543
H -3.216916 0.726098 -3.071324
H -2.323243 -2.728828 2.635991
H -4.005817 -2.125469 2.708313
H -3.681135 -3.802931 2.167063


