%chk=000101160.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101160

0 1
 O    4.611400      0.5879000      0.3567000    
 O    7.330900     -0.1590000      0.5163000    
 O    7.997100      -2.831000      0.1928000    
 C   -4.216400     -0.1365000     -3.9999999E-02
 C   -5.692300      0.2406000     -0.1862000    
 C   -3.261600       1.029700     -0.3138000    
 C   -6.602400     -0.9521000      0.1204000    
 C   -1.788000      0.6707000     -9.4700001E-02
 C   -8.078800     -0.5642000      1.1400000E-02
 C  -0.8396000       1.841300     -0.3816000    
 C   -9.033300      -1.729800      0.2791000    
 C   0.6174000       1.506000     -0.1843000    
 C   -10.50130      -1.333300      0.2422000    
 C    1.197800       1.700400       1.059600    
 C    1.351700       1.009200      -1.250300    
 C    3.296400      0.8898000      0.1783000    
 C    2.545600       1.390600       1.241900    
 C    2.699400      0.6993000      -1.067900    
 C    5.150700     -0.4634000     -0.4431000    
 C    6.307300      -1.131300      0.2918000    
 C    6.908000      -2.265200     -0.5286000    
 H   -3.981400     -0.9607000     -0.7247000    
 H   -4.040300     -0.5096000      0.9767000    
 H   -5.880300      0.5977000      -1.205800    
 H   -5.926500       1.067500      0.4952000    
 H   -3.524600       1.871100      0.3392000    
 H   -3.401700       1.373300      -1.346100    
 H   -6.397200      -1.324800       1.131100    
 H   -6.385100      -1.769900     -0.5771000    
 H   -1.648500      0.3320000      0.9397000    
 H   -1.525200     -0.1787000     -0.7379000    
 H   -8.277500     -0.1635000     -0.9904000    
 H   -8.291200      0.2437000      0.7228000    
 H  -0.9920000       2.193900      -1.410400    
 H   -1.104000       2.693500      0.2584000    
 H   -8.811300      -2.162000       1.262200    
 H   -8.858700      -2.519200     -0.4615000    
 H   -11.13550      -2.203400      0.4381000    
 H   -10.77080     -0.9279000     -0.7382000    
 H   -10.71970     -0.5742000      0.9998000    
 H   0.6209000       2.087700       1.894500    
 H   0.8961000      0.8611000      -2.225300    
 H    3.005100       1.540500       2.215100    
 H    3.253500      0.3372000      -1.928700    
 H    4.396700      -1.233300     -0.6524000    
 H    5.504000     -2.6699999E-02  -1.385100    
 H    5.994800      -1.482800       1.280700    
 H    6.172900      -3.053700     -0.7148000    
 H    7.296100      -1.910500      -1.489200    
 H    7.623600      0.1746000     -0.3491000    
 H    8.639400      -2.119300      0.3564000    


%chk=000101160-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101160

0 1
O 4.559977 -0.206711 0.546768
O 7.330953 0.217533 0.714322
O 9.112570 -1.713439 -0.085893
C -4.383489 -0.157873 0.078256
C -5.842586 0.270175 -0.197545
C -3.342022 0.885819 -0.384502
C -6.885078 -0.766394 0.278996
C -1.884377 0.448499 -0.120949
C -8.344231 -0.341834 -0.001575
C -0.843823 1.512959 -0.568252
C -9.386850 -1.375491 0.482461
C 0.592884 1.081399 -0.315084
C -10.841633 -0.943812 0.197191
C 1.162186 1.169380 0.985068
C 1.394950 0.542938 -1.349119
C 3.256369 0.200304 0.190597
C 2.475886 0.736627 1.242967
C 2.718141 0.100864 -1.113610
C 5.426017 -0.753705 -0.512494
C 6.764605 -1.032343 0.171303
C 7.842780 -1.555247 -0.789684
H -4.183686 -1.125291 -0.428327
H -4.255757 -0.345104 1.165082
H -5.973058 0.447066 -1.285896
H -6.039560 1.242855 0.300391
H -3.535352 1.850419 0.130788
H -3.476125 1.081921 -1.469254
H -6.757232 -0.939545 1.368306
H -6.685928 -1.740624 -0.215079
H -1.747957 0.239454 0.959677
H -1.677997 -0.504144 -0.649473
H -8.475439 -0.174264 -1.091399
H -8.543534 0.634558 0.488231
H -0.991458 1.721235 -1.646245
H -1.057645 2.458832 -0.030669
H -9.255784 -1.541789 1.571384
H -9.186205 -2.350875 -0.006451
H -11.566968 -1.698137 0.554090
H -11.007323 -0.802310 -0.887696
H -11.075675 0.014342 0.698775
H 0.567616 1.588780 1.806088
H 0.982988 0.466949 -2.362966
H 2.913581 0.806286 2.243870
H 3.305230 -0.307245 -1.941786
H 4.987209 -1.684394 -0.927405
H 5.550332 -0.005407 -1.321563
H 6.613037 -1.759312 0.996041
H 7.577644 -2.555415 -1.171927
H 7.944531 -0.849591 -1.642880
H 6.645461 0.638139 1.293215
H 9.253426 -0.873734 0.427054


