%chk=000135391.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135391

0 1
 O    7.022000      -1.612000      0.2644000    
 O    7.150900      0.5346000     -0.4399000    
 C   -4.266700      -1.548500     -0.2383000    
 C   -5.744600      -1.410200      0.2124000    
 C   -3.477000     -0.2556000      1.8000000E-03
 C   -6.366100     -9.4200000E-02 -0.2321000    
 C   -5.626100       1.068100      0.4138000    
 C   -4.128100      0.9657000      0.2795000    
 C   -3.669200      -2.735100      0.5519000    
 C   -4.213900      -1.888800      -1.743800    
 C   -2.071400     -0.2510000     -9.8499998E-02
 C   -3.369300       2.131000      0.4903000    
 C   -1.331300      0.9156000      0.1009000    
 C   -1.980100       2.106300      0.4000000    
 C   0.1116000      0.8838000     -2.4999999E-03
 C   0.8091000     -0.2807000      0.3203000    
 C   0.8028000       2.015800     -0.4238000    
 C    2.209600     -0.3267000      0.2257000    
 C    2.912300      0.8246000     -0.2026000    
 C    2.194000       1.987900     -0.5239000    
 C    2.928100      -1.490000      0.5464000    
 C    4.312800      0.7787000     -0.2972000    
 C    5.010500     -0.3853000      2.6100000E-02
 C    4.319300      -1.517600      0.4468000    
 C    6.460900     -0.4164000     -7.7900000E-02
 H   -5.809100      -1.469100       1.308000    
 H   -6.341000      -2.245900     -0.1748000    
 H   -7.422200     -6.1600000E-02  5.9000000E-02
 H   -6.337200     -4.3000001E-03  -1.323900    
 H   -5.869900       1.107900       1.483100    
 H   -5.980000       2.002100     -3.9299998E-02
 H   -4.295700      -3.629000      0.4488000    
 H   -2.667900      -3.009300      0.2033000    
 H   -3.593700      -2.501300       1.620400    
 H   -3.190100      -2.099200      -2.074600    
 H   -4.816300      -2.776100      -1.969500    
 H   -4.586000      -1.064900      -2.362600    
 H   -1.577000      -1.176200     -0.3822000    
 H   -3.865300       3.068400      0.7320000    
 H   -1.448600       3.032500      0.5990000    
 H   0.2945000      -1.167800      0.6848000    
 H   0.3008000       2.934500     -0.7153000    
 H    2.713500       2.882300     -0.8618000    
 H    2.408700      -2.387100      0.8774000    
 H    4.854100       1.664100     -0.6268000    
 H    4.826900      -2.442400      0.7068000    
 H    7.999300      -1.592400      0.1811000    


%chk=000135391-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135391

0 1
O 7.186909 -1.604876 0.305137
O 7.306878 0.561705 -0.520441
C -4.340375 -1.554650 -0.262358
C -5.830482 -1.417731 0.175914
C -3.558978 -0.247276 0.014066
C -6.463253 -0.074636 -0.236639
C -5.729238 1.077355 0.476878
C -4.214639 0.979648 0.332819
C -3.725215 -2.748214 0.523902
C -4.271710 -1.871780 -1.787959
C -2.146014 -0.248511 -0.098472
C -3.428141 2.143504 0.532436
C -1.354806 0.909730 0.108929
C -2.026918 2.121506 0.426996
C 0.130065 0.860337 -0.000479
C 0.855771 -0.287061 0.365620
C 0.861267 2.002646 -0.489783
C 2.279772 -0.344318 0.259484
C 2.999371 0.813705 -0.235003
C 2.248574 1.979857 -0.603475
C 3.027538 -1.511698 0.637165
C 4.420853 0.759544 -0.340384
C 5.124666 -0.396011 0.033009
C 4.415335 -1.543301 0.528293
C 6.602716 -0.389408 -0.098893
H -5.894171 -1.512789 1.280030
H -6.400018 -2.266490 -0.250472
H -7.537637 -0.059763 0.027171
H -6.399482 0.057557 -1.334097
H -5.991496 1.052507 1.556099
H -6.075459 2.058626 0.099443
H -4.356907 -3.647453 0.394152
H -2.710468 -3.004898 0.170318
H -3.664770 -2.522214 1.604132
H -3.224309 -1.948168 -2.131635
H -4.774353 -2.834211 -2.001742
H -4.760866 -1.084121 -2.388742
H -1.640033 -1.177547 -0.385223
H -3.933630 3.084974 0.782187
H -1.452747 3.034706 0.618907
H 0.327505 -1.156962 0.773690
H 0.305861 2.892033 -0.805669
H 2.784976 2.854991 -0.988556
H 2.485865 -2.386408 1.015564
H 4.981877 1.623641 -0.714518
H 4.986025 -2.430440 0.814410
H 8.172191 -1.532439 0.190487


