%chk=000072391.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072391

0 1
 O    4.263400      -1.623800      -1.083400    
 O    5.798300     -0.3164000      0.2366000    
 O   -2.120100      -2.492700      2.5400000E-02
 O   -6.278700     -0.5480000       1.304700    
 C   0.3112000      0.4781000      0.9996000    
 C    1.799900      0.2898000      0.8194000    
 C  -0.2795000       1.539500      8.9199997E-02
 C   -1.380000     -0.1757000      -1.473100    
 C  -0.6798000       1.155600      -1.270500    
 C    2.255200     -0.6369000     -0.1076000    
 C    3.622100     -0.7734000     -0.2363000    
 C   -2.688400     -0.2887000     -0.7250000    
 C    4.498600     -2.6900001E-02  0.5174000    
 C    2.676600       1.054800       1.591900    
 C    4.056600      0.8972000       1.441800    
 C   -2.986300      -1.441800     -1.6799999E-02
 C    5.641900      -1.328400     -0.7788000    
 C   -3.570600      0.7796000     -0.7661000    
 C  -0.4169000       2.801500      0.5328000    
 C  -0.4468000       1.957300      -2.324800    
 C   -4.198000      -1.529500      0.6683000    
 C   -4.782300      0.6919000     -8.0899999E-02
 C   -5.096200     -0.4627000      0.6362000    
 H   0.1216000      0.7499000       2.048700    
 H  -0.1974000     -0.4862000      0.8996000    
 H  -0.6692000     -0.9645000      -1.216300    
 H   -1.607300     -0.3359000      -2.536300    
 H    1.581500      -1.237900     -0.7058000    
 H    2.301400       1.776100       2.312800    
 H    4.750400       1.483100       2.033800    
 H    6.138100     -0.9866000      -1.694400    
 H    6.130300      -2.247900     -0.4361000    
 H   -3.358600       1.682000      -1.331500    
 H  -0.1130000       3.077600       1.537800    
 H  -0.8450000       3.591400     -7.5700000E-02
 H  -0.7501000       1.669400      -3.326600    
 H   6.1400000E-02   2.911600      -2.231500    
 H   -4.436700      -2.432000       1.225700    
 H   -5.479700       1.524600     -0.1126000    
 H   -1.667700      -2.573000     -0.8299000    
 H   -6.330200      -1.413800       1.745100    


%chk=000072391-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072391

0 1
O 3.538925 -2.694335 0.414721
O 5.188257 -1.199493 -0.496595
O -1.109203 -2.232973 -0.370990
O -5.769091 -1.718446 0.868027
C 0.202660 1.030765 1.271117
C 1.530905 0.485173 0.741253
C -0.404298 2.190805 0.479850
C -1.009608 0.585397 -1.474347
C -0.668585 1.995068 -0.983080
C 1.801711 -0.915150 0.841301
C 3.049597 -1.363803 0.402926
C -2.232708 -0.048290 -0.810143
C 4.017059 -0.487361 -0.130750
C 2.512624 1.355619 0.204573
C 3.777090 0.883128 -0.244045
C -2.238014 -1.388778 -0.332993
C 4.908287 -2.622629 -0.165296
C -3.441427 0.685096 -0.692499
C -0.734722 3.352488 1.113562
C -0.576727 3.022275 -1.875740
C -3.397079 -1.969887 0.229162
C -4.609258 0.132808 -0.136283
C -4.578560 -1.205152 0.322794
H 0.341010 1.363997 2.318222
H -0.533258 0.203741 1.314464
H -0.103166 -0.039194 -1.327163
H -1.162565 0.627941 -2.570035
H 1.072286 -1.607349 1.274595
H 2.289220 2.425144 0.132355
H 4.529622 1.560010 -0.656383
H 4.936653 -3.220547 -1.092855
H 5.635577 -2.966502 0.590073
H -3.454279 1.722857 -1.045342
H -0.513986 3.505592 2.176246
H -1.256332 4.164357 0.595360
H -0.800839 2.876292 -2.938790
H -0.256617 4.024506 -1.571271
H -3.345258 -3.007560 0.578373
H -5.534943 0.707528 -0.049293
H -0.323528 -1.768202 -0.755476
H -5.647435 -2.656637 1.157194


