%chk=000115175.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115175

0 1
 O    4.575000      0.3439000      6.2399998E-02
 O    6.832500      0.6777000     -1.4900000E-02
 O    10.30250     -0.1992000     -0.1785000    
 O    9.394500       1.871900     -7.5900003E-02
 C   -4.197700     -0.4314000      0.1094000    
 C   -5.494900      0.3827000      0.1685000    
 C   -2.933900      0.4314000      0.1486000    
 C   -6.793900     -0.4286000      0.1057000    
 C   -1.670700     -0.4319000      0.1113000    
 C   -8.053600      0.4406000      0.1097000    
 C  -0.3740000      0.3847000      0.1354000    
 C   -9.348200     -0.3674000     -3.1800002E-02
 C   0.8887000     -0.4816000      0.1730000    
 C   -10.63780      0.4550000     -0.1269000    
 C    2.182400      0.3335000      0.1269000    
 C   -11.90230     -0.4007000     -0.2134000    
 C    3.443900     -0.5179000      7.8299999E-02
 C   -13.15100      0.4619000     -0.3131000    
 C    5.800500     -0.2059000     -3.1999999E-03
 C    6.269600      -1.497500     -6.3600004E-02
 C    7.680700      -1.401300     -0.1157000    
 C    7.973300     -5.7700001E-02 -8.3400004E-02
 C    9.214400      0.6380000     -0.1091000    
 H   -4.184100      -1.136200      0.9499000    
 H   -4.196900      -1.033000     -0.8079000    
 H   -5.496600      0.9766000       1.091300    
 H   -5.491400       1.101300     -0.6611000    
 H   -2.933400       1.121100     -0.7038000    
 H   -2.934000       1.042200       1.059300    
 H   -6.783100      -1.042500     -0.8033000    
 H   -6.827500      -1.121500      0.9552000    
 H   -1.677800      -1.115700      0.9693000    
 H   -1.682500      -1.056000     -0.7908000    
 H   -7.995000       1.160900     -0.7155000    
 H   -8.091600       1.024200       1.037400    
 H  -0.3442000       1.031600     -0.7500000    
 H  -0.3789000       1.045800       1.010800    
 H   -9.426900      -1.051200      0.8230000    
 H   -9.274000     -0.9989000     -0.9264000    
 H   0.8717000      -1.172700     -0.6788000    
 H   0.8803000      -1.097100       1.080800    
 H   -10.57830       1.108000      -1.006300    
 H   -10.70500       1.111100      0.7498000    
 H    2.229500      0.9987000      0.9986000    
 H    2.170300      0.9975000     -0.7470000    
 H   -11.84590      -1.057700      -1.088900    
 H   -11.97630      -1.043700      0.6712000    
 H    3.437800      -1.139500     -0.8252000    
 H    3.488600      -1.168600      0.9599000    
 H   -13.25170       1.109300      0.5639000    
 H   -13.12070       1.094300      -1.206000    
 H   -14.04320     -0.1691000     -0.3738000    
 H    5.677100      -2.401200     -6.9700003E-02
 H    8.388100      -2.216800     -0.1699000    
 H    11.14450      0.3042000     -0.1949000    


%chk=000115175-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115175

0 1
O 4.633249 0.446499 0.052394
O 6.917943 0.743297 0.091612
O 10.435713 -0.299696 0.104021
O 9.577627 1.876584 0.165642
C -4.239292 -0.452086 -0.016316
C -5.524088 0.406637 -0.011278
C -2.942528 0.388335 -0.004402
C -6.822320 -0.431632 -0.020822
C -1.657194 -0.469607 -0.009361
C -8.106097 0.428630 -0.015784
C -0.362818 0.374001 0.007033
C -9.405361 -0.408294 -0.024664
C 0.922747 -0.483827 0.000603
C -10.688844 0.452538 -0.019085
C 2.207692 0.377130 0.024903
C -11.988607 -0.384436 -0.028550
C 3.468022 -0.484095 0.013749
C -13.264924 0.484665 -0.022080
C 5.856287 -0.150049 0.048012
C 6.307418 -1.474753 0.009987
C 7.741152 -1.400653 0.031252
C 8.098433 -0.055185 0.080701
C 9.374943 0.639530 0.121570
H -4.246742 -1.127049 0.865177
H -4.242039 -1.109793 -0.910794
H -5.520609 1.065441 0.882371
H -5.517432 1.080950 -0.893264
H -2.935918 1.063588 -0.885486
H -2.940800 1.045654 0.890188
H -6.826585 -1.090681 -0.914350
H -6.829704 -1.105563 0.861485
H -1.665841 -1.146397 0.870659
H -1.657953 -1.124739 -0.905663
H -8.098868 1.102564 -0.898078
H -8.101666 1.087924 0.877510
H -0.355135 1.051610 -0.871671
H -0.362188 1.027406 0.903938
H -9.412817 -1.082324 0.857655
H -9.410469 -1.067452 -0.918188
H 0.922567 -1.132848 -0.899967
H 0.910745 -1.163639 0.878040
H -10.682765 1.127000 -0.901053
H -10.685574 1.111385 0.874629
H 2.217213 1.016195 0.928022
H 2.226299 1.053970 -0.850087
H -11.991266 -1.041854 -0.922047
H -11.993608 -1.058406 0.852498
H 3.536903 -1.097594 -0.907110
H 3.518048 -1.147996 0.900240
H -13.300678 1.128406 0.877185
H -13.297400 1.146426 -0.908291
H -14.179856 -0.136108 -0.030018
H 5.696723 -2.372812 -0.027890
H 8.446601 -2.228234 0.013077
H 11.290558 0.207038 0.132943


