%chk=000169883.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169883

0 1
 O   -2.673100      -2.811800      -1.210600    
 O    4.188100      0.2846000      -1.793400    
 O    4.612100       2.293100      8.0100000E-02
 O   -1.586100       2.900100     -0.3860000    
 O   -4.266300       3.065900      0.3328000    
 C  -0.1395000      -1.933200       1.018800    
 C  -0.4581000      -2.154200     -0.4885000    
 C    1.355700      -2.134000       1.361500    
 C  -0.9865000      -2.826800       1.937200    
 C  -3.5900000E-02  -3.531800      -1.015300    
 C   -1.950800      -1.920200     -0.7661000    
 C    2.227800     -0.9517000       1.015600    
 C   -2.564400     -0.5901000     -0.4739000    
 C    2.810500     -0.8812000     -0.2401000    
 C    2.429200      4.2599998E-02   1.960000    
 C    3.616000      0.2119000     -0.5594000    
 C   -1.776500      0.5335000     -0.5692000    
 C   -3.893500     -0.5420000     -0.1217000    
 C    3.235000       1.135500       1.640500    
 C    3.828400       1.220200      0.3808000    
 C   -2.349800       1.775500     -0.2966000    
 C   -4.466600      0.7002000      0.1513000    
 C   -3.694800       1.859000      6.3900001E-02
 C    3.441600      0.9404000      -2.816600    
 C  -0.9023000       3.314600      0.7950000    
 H  -0.4031000     -0.9027000       1.287200    
 H   9.8099999E-02  -1.430600      -1.094000    
 H    1.457300      -2.302200       2.443500    
 H    1.765100      -3.047300      0.9171000    
 H  -0.8033000      -2.577800       2.988600    
 H   -2.058300      -2.695800       1.762500    
 H  -0.7449000      -3.885800       1.803600    
 H  -0.3415000      -3.652000      -2.061500    
 H  -0.4998000      -4.345800     -0.4498000    
 H    1.048300      -3.666700     -0.9909000    
 H    2.652600      -1.666400     -0.9739000    
 H    1.968600     -1.1700000E-02   2.942300    
 H  -0.7337000      0.5012000     -0.8643000    
 H   -4.504400      -1.436000     -4.3600000E-02
 H    3.395200       1.918600       2.376700    
 H   -5.515100      0.7507000      0.4324000    
 H    4.972700       2.171500     -0.8150000    
 H    3.222300       1.975200      -2.535300    
 H    2.510100      0.4005000      -3.014400    
 H    4.043200      0.9461000      -3.729500    
 H   -5.200800       2.929200      0.5649000    
 H   -1.614500       3.533000       1.596800    
 H  -0.3433000       4.225800      0.5654000    
 H  -0.1962000       2.543300       1.119200    


%chk=000169883-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169883

0 1
O -2.940740 -2.840826 -0.245072
O 3.355037 1.311138 -1.727782
O 3.100373 3.069854 0.270451
O -0.638904 2.790393 -0.360990
O -3.379366 3.603575 -0.100774
C -0.007358 -2.543575 1.181698
C -0.536185 -2.427234 -0.302719
C 1.551465 -2.401131 1.240490
C -0.475990 -3.841738 1.876199
C -0.375289 -3.728168 -1.118116
C -2.006629 -1.979041 -0.260130
C 2.032022 -0.979002 0.988091
C -2.332110 -0.513817 -0.191047
C 2.511087 -0.576229 -0.289475
C 1.952838 -0.008058 2.017748
C 2.870873 0.766467 -0.518919
C -1.343876 0.505579 -0.241520
C -3.696902 -0.130295 -0.079938
C 2.315783 1.339028 1.790809
C 2.762745 1.734210 0.518937
C -1.686031 1.871917 -0.202741
C -4.053433 1.226993 -0.031344
C -3.060923 2.236524 -0.103128
C 3.438900 0.425657 -2.889061
C -0.520200 3.884486 0.628904
H -0.422983 -1.684084 1.747785
H 0.059683 -1.632400 -0.787335
H 1.875884 -2.727966 2.248204
H 2.007957 -3.105229 0.517707
H -0.232786 -3.808922 2.954749
H -1.566538 -3.980913 1.771251
H 0.021576 -4.730907 1.447473
H -0.579584 -3.542837 -2.188389
H -1.087574 -4.495549 -0.774475
H 0.651346 -4.129723 -1.032719
H 2.601726 -1.320787 -1.088145
H 1.598662 -0.307083 3.011308
H -0.276068 0.279896 -0.310094
H -4.454582 -0.918613 -0.038819
H 2.253239 2.090492 2.583727
H -5.110537 1.516101 0.046277
H 3.362923 3.147877 -0.685413
H 2.443243 0.016167 -3.146362
H 4.148998 -0.403239 -2.704577
H 3.807396 1.054445 -3.712639
H -4.360151 3.732482 -0.067982
H -1.334655 4.616912 0.504024
H 0.461788 4.336558 0.424892
H -0.531349 3.475015 1.657080


