%chk=000074223.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074223

0 1
 O   -4.307700       1.544600     -0.4666000    
 O   -2.669500      -2.536000       1.391800    
 O   0.3982000       4.331000      0.2198000    
 O    2.613600      -3.558900      0.1986000    
 C   -4.240300      0.1616000     -0.4816000    
 C   -3.413200      -1.879900      0.4599000    
 C   -3.145400       2.232700     -0.2969000    
 C   -1.342200      -2.792900       1.091800    
 C   -3.478900     -0.4868000      0.4740000    
 C  -0.7841000       3.631000      4.7499999E-02
 C    1.309200      -3.306400      0.4931000    
 C   -4.938300     -0.5360000      -1.450900    
 C   -4.110100      -2.601100     -0.5096000    
 C   -3.094400       3.307500      0.5907000    
 C   -2.005500       1.863100      -1.010700    
 C   -1.012100      -3.975200      0.4541000    
 C  -0.3805000      -1.861000       1.437900    
 C   -4.872600      -1.929200      -1.465100    
 C   -1.903600       4.012700      0.7643000    
 C  -0.8145000       2.568300     -0.8370000    
 C   0.3249000      -4.234100      0.1522000    
 C   0.9565000      -2.119800       1.135900    
 C    1.544500       3.611300      0.3629000    
 C    3.358600      -2.532300     -0.3569000    
 C    1.571200       2.503100       1.209600    
 C    2.692900       3.982400     -0.3364000    
 C    2.811100      -1.779900      -1.380300    
 C    4.631400      -2.286400      0.1252000    
 C    2.746300       1.766000       1.357100    
 C    3.868000       3.245400     -0.1891000    
 C    3.561900     -0.7464000      -1.940500    
 C    5.382200      -1.252800     -0.4349000    
 C    3.894600       2.137200      0.6577000    
 C    4.847500     -0.4829000      -1.467900    
 H   -2.954800      5.9999999E-02   1.253000    
 H   -5.532500     -1.4200000E-02  -2.194900    
 H   -4.070400      -3.686800     -0.5257000    
 H   -3.979000       3.599600       1.150100    
 H   -2.023100       1.047700      -1.729100    
 H   -1.773100      -4.703700      0.1916000    
 H  -0.6476000     -0.9400000       1.947300    
 H   -5.416200      -2.490900      -2.219100    
 H   -1.865100       4.848800       1.455900    
 H   5.1600002E-02   2.278500      -1.425000    
 H   0.5937000      -5.160600     -0.3478000    
 H    1.704500      -1.391500       1.436200    
 H   0.6991000       2.204400       1.785300    
 H    2.678400       4.844900     -0.9970000    
 H    1.821800      -1.979600      -1.781600    
 H    5.048700      -2.884500      0.9297000    
 H    2.770900      0.9095000       2.024200    
 H    4.763200       3.536100     -0.7308000    
 H    3.147300     -0.1491000      -2.747300    
 H    6.382900      -1.046900     -6.6399999E-02
 H    4.814100       1.575100      0.7866000    
 H    5.432500      0.3211000      -1.904800    


%chk=000074223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000074223

0 1
O -3.857793 1.898678 -0.882026
O -0.813624 -1.540147 0.729387
O -1.659111 6.520831 1.471328
O 3.318288 -5.314609 0.078173
C -3.234712 0.634440 -0.996212
C -1.740366 -1.131968 -0.261881
C -3.208613 2.988905 -0.243832
C 0.170971 -2.524322 0.454166
C -2.244360 0.176692 -0.100006
C -2.111005 5.294194 0.923975
C 2.231432 -4.405428 0.131042
C -3.723940 -0.193313 -2.033161
C -2.211541 -1.986549 -1.285985
C -4.020132 3.818590 0.559349
C -1.853951 3.316158 -0.484420
C 0.502509 -3.388231 1.520492
C 0.878501 -2.582435 -0.769512
C -3.207529 -1.499029 -2.162609
C -3.469123 4.976367 1.145473
C -1.301697 4.473335 0.103001
C 1.536823 -4.332339 1.358475
C 1.912908 -3.527496 -0.931928
C -0.331736 6.663651 1.952721
C 3.625039 -6.018203 -1.115204
C 0.381262 5.610515 2.572491
C 0.215461 7.962903 1.866002
C 2.638395 -6.441002 -2.036858
C 4.983230 -6.363415 -1.292086
C 1.666253 5.871472 3.098742
C 1.498842 8.208393 2.400424
C 3.031249 -7.210445 -3.154914
C 5.359055 -7.135998 -2.412314
C 2.231950 7.165205 3.014485
C 4.387970 -7.559315 -3.350720
H -1.871264 0.794720 0.720377
H -4.495611 0.192562 -2.704398
H -1.828192 -3.005524 -1.385573
H -5.068757 3.549090 0.713402
H -1.240288 2.687044 -1.136342
H -0.051212 -3.309302 2.460266
H 0.638808 -1.888159 -1.580542
H -3.588238 -2.151727 -2.955427
H -4.074104 5.638337 1.771411
H -0.259210 4.742181 -0.092258
H 1.815314 -5.012910 2.167943
H 2.476538 -3.566797 -1.869027
H -0.061410 4.613049 2.655206
H -0.370003 8.754135 1.388294
H 1.585760 -6.186932 -1.878286
H 5.716596 -6.026430 -0.553416
H 2.220807 5.060120 3.583207
H 1.926225 9.214976 2.334432
H 2.270152 -7.544108 -3.869089
H 6.411825 -7.404858 -2.552265
H 3.228205 7.358912 3.425605
H 4.683753 -8.156663 -4.219480


