%chk=000114526.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114526

0 1
 O   -1.578400     -0.7141000     -4.2100001E-02
 O   -3.050800     -0.2915000       1.676100    
 C    2.916300      0.9263000      0.2583000    
 C    1.897800     -0.1808000      0.6556000    
 C    1.314500      -1.027000     -0.5044000    
 C   0.3588000      -2.122400      9.1000004E-03
 C    2.936000       2.079900       1.272200    
 C    2.601700       1.482900      -1.141800    
 C    4.321800      0.2917000      0.2181000    
 C    2.444500      -1.693500      -1.301300    
 C  -0.8202000      -1.569900      0.8039000    
 C   -2.677500     -0.1338000      0.5223000    
 C   -3.366600      0.7278000     -0.4783000    
 C   -2.825200      0.8526000      -1.869500    
 C   -4.472700       1.371900     -7.8000002E-02
 H    1.057300      0.3314000       1.139900    
 H    2.327300     -0.8370000       1.423800    
 H   0.7469000     -0.3844000      -1.187500    
 H   0.9081000      -2.835800      0.6355000    
 H  -3.1900000E-02  -2.679000     -0.8525000    
 H    3.687700       2.833700       1.012800    
 H    3.164400       1.712000       2.278700    
 H    1.962700       2.581500       1.313400    
 H    3.213600       2.375500      -1.328500    
 H    1.557600       1.811500      -1.202900    
 H    2.803400      0.8284000      -1.984400    
 H    5.084200       1.071600      9.4999999E-02
 H    4.549700     -0.2263000       1.156700    
 H    4.485400     -0.4079000     -0.6001000    
 H    3.018000      -1.045400      -1.956100    
 H    2.017600      -2.448100      -1.974800    
 H    3.130000      -2.231700     -0.6371000    
 H   -1.453800      -2.408300       1.117800    
 H  -0.4958000      -1.037600       1.703400    
 H   -1.808400       1.258900      -1.851100    
 H   -2.803700     -0.1247000      -2.362700    
 H   -3.435100       1.520000      -2.487900    
 H   -5.019900       2.014800     -0.7606000    
 H   -4.869200       1.285300      0.9280000    


%chk=000114526-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114526

0 1
O -1.614875 -0.635232 -0.071960
O -3.166350 0.010004 1.543001
C 3.056209 0.926579 0.313306
C 2.181790 -0.314182 0.710729
C 1.365571 -1.076871 -0.372488
C 0.339874 -2.030339 0.312047
C 3.351323 1.713047 1.623473
C 2.296889 1.860918 -0.665665
C 4.420629 0.516568 -0.307417
C 2.240738 -1.892417 -1.353976
C -0.840083 -1.338517 0.996162
C -2.781789 0.014121 0.346242
C -3.470052 0.686538 -0.807423
C -2.844032 0.601339 -2.184067
C -4.632084 1.344049 -0.540078
H 1.461602 0.049449 1.473372
H 2.835639 -1.044998 1.235083
H 0.776545 -0.344780 -0.959088
H 0.859738 -2.647354 1.074924
H -0.066370 -2.732981 -0.441482
H 4.016670 2.574774 1.425902
H 3.847987 1.065444 2.371393
H 2.417890 2.099261 2.075093
H 2.864153 2.798327 -0.820640
H 1.299060 2.130145 -0.269361
H 2.155015 1.389754 -1.655808
H 5.050943 1.411929 -0.470279
H 4.971859 -0.165874 0.367515
H 4.304332 0.009784 -1.279963
H 2.865223 -1.243168 -1.990311
H 1.608824 -2.502642 -2.026804
H 2.916766 -2.579061 -0.807770
H -1.514462 -2.059474 1.493201
H -0.534120 -0.588295 1.747841
H -1.828033 1.036151 -2.184325
H -2.733624 -0.449991 -2.504765
H -3.458801 1.137289 -2.926940
H -5.191328 1.858919 -1.328683
H -5.033168 1.370287 0.479012


