%chk=000076865.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076865

0 1
 O   -3.489600      5.7000000E-02 -0.2658000    
 O  -0.3255000      -2.700300     -0.2819000    
 O    5.056800      0.4060000      0.4142000    
 C   -1.338700     -0.5956000     -0.1631000    
 C   -1.375100      0.8180000     -3.4699999E-02
 C   -2.644500      -1.006300     -0.3006000    
 C   -2.719300       1.169500     -0.1039000    
 C   -3.276800      -2.323100     -0.4725000    
 C  -0.1965000      -1.463100     -0.1570000    
 C  -0.4220000       1.837900      0.1325000    
 C    1.214200     -0.9618000     -3.5000001E-03
 C   -3.190200       2.478400     -1.8500000E-02
 C   -3.641300      -2.993300      0.8588000    
 C  -0.8654000       3.164600      0.2215000    
 C   -2.225400       3.476500      0.1469000    
 C    1.729700     -0.8575000       1.261700    
 C    1.911200     -0.6349000      -1.137100    
 C    3.037000     -0.3925000       1.403800    
 C    3.218600     -0.1699000     -0.9952000    
 C    3.781700     -4.8900001E-02  0.2754000    
 C    5.761200      0.7393000     -0.7811000    
 H   -4.196500      -2.207900      -1.060100    
 H   -2.639200      -2.994400      -1.056500    
 H   0.6419000       1.647200      0.1957000    
 H   -4.246500       2.712500     -7.7100001E-02
 H   -4.329700      -2.367600       1.436800    
 H   -2.748200      -3.165500       1.468700    
 H   -4.124300      -3.958300      0.6765000    
 H  -0.1390000       3.962900      0.3506000    
 H   -2.539800       4.514800      0.2190000    
 H    1.151700      -1.124100       2.140800    
 H    1.473500     -0.7285000      -2.125900    
 H    3.469900     -0.2996000       2.396100    
 H    3.739700      7.9700001E-02  -1.913100    
 H    6.757900       1.081800     -0.4840000    
 H    5.282900       1.569500      -1.311700    
 H    5.902400     -0.1372000      -1.422700    


%chk=000076865-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076865

0 1
O -3.404433 -0.017228 -0.694330
O -0.457028 -2.488393 1.201892
O 5.357994 -0.111855 0.019239
C -1.298170 -0.524973 0.118661
C -1.425582 0.937715 0.062217
C -2.513550 -1.052804 -0.324679
C -2.732623 1.201873 -0.437871
C -3.041414 -2.442880 -0.466956
C -0.191874 -1.377090 0.626761
C -0.615197 2.044663 0.424759
C 1.232321 -0.957117 0.447878
C -3.269843 2.480809 -0.627293
C -3.917069 -2.866278 0.746439
C -1.132173 3.346648 0.250380
C -2.436845 3.566946 -0.273689
C 2.219639 -1.524396 1.305395
C 1.655012 -0.093501 -0.594852
C 3.576385 -1.218284 1.144174
C 3.019413 0.209770 -0.783364
C 3.983173 -0.347654 0.096349
C 5.845766 0.771090 -1.046011
H -3.635497 -2.507851 -1.398170
H -2.185890 -3.134760 -0.543648
H 0.387478 1.896493 0.835602
H -4.280850 2.624657 -1.018143
H -4.771163 -2.179355 0.879534
H -3.307670 -2.865980 1.665594
H -4.311512 -3.885820 0.588307
H -0.516887 4.209383 0.528183
H -2.805410 4.590757 -0.397102
H 1.889445 -2.212830 2.089877
H 0.916052 0.327394 -1.284391
H 4.342835 -1.636651 1.803178
H 3.316430 0.864715 -1.607505
H 6.935386 0.812885 -0.905277
H 5.416894 1.787168 -0.951887
H 5.613255 0.358036 -2.046251


