%chk=000154429.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154429

0 1
 O   -3.931000       1.341300       1.351700    
 O   -4.105700      -2.588700     -0.4087000    
 O   -6.102800     -0.7037000     -0.3438000    
 C   -2.099100      0.4898000      4.1099999E-02
 C  -0.7315000      0.9115000     -1.6600000E-02
 C   0.3350000     -3.1900000E-02 -0.1109000    
 C   -3.165900       1.383800      0.2305000    
 C    1.737100      0.4054000     -6.9100000E-02
 C   -2.430000     -0.8731000     -0.1199000    
 C   -4.524600      0.9801000      0.1784000    
 C    1.957000       1.803900     -0.1841000    
 C    2.943700     -0.4198000      7.8599997E-02
 C  -6.9700003E-02  -1.372700     -0.3090000    
 C  -0.4096000       2.273500     -4.1999999E-03
 C   -3.778200      -1.279200     -0.1855000    
 C   -1.403800      -1.790400     -0.3033000    
 C   -4.812000     -0.3420000     -0.1048000    
 C   0.8997000       2.708700     -0.1365000    
 C    4.230000      0.1541000     -0.1300000    
 C    3.238300       2.334900     -0.3467000    
 C    4.355200       1.517100     -0.3674000    
 C    2.967100      -1.778900      0.4902000    
 C    5.403500     -0.6180000     -6.5300003E-02
 C    4.138900      -2.541000      0.5685000    
 C    5.358400      -1.964800      0.2670000    
 H   0.6517000      -2.145000     -0.5553000    
 H   -1.182100       3.038100      5.2900001E-02
 H   -1.585600      -2.844600     -0.4937000    
 H    1.079000       3.781700     -0.1871000    
 H    3.387000       3.406800     -0.4708000    
 H    5.331200       1.974700     -0.5163000    
 H    2.065400      -2.280100      0.8262000    
 H    6.376000     -0.1656000     -0.2524000    
 H    4.088700      -3.579800      0.8820000    
 H    6.272400      -2.547100      0.3254000    
 H   -3.452300      -3.166600      1.6799999E-02
 H   -6.122000      -1.657300     -0.5365000    


%chk=000154429-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154429

0 1
O -4.279391 2.246241 0.608731
O -4.097333 -2.728451 -0.242966
O -6.124863 -1.025726 0.406569
C -2.056036 0.525462 -0.105376
C -0.682360 0.980073 -0.070679
C 0.386862 0.027324 -0.205515
C -3.233075 1.272497 -0.028345
C 1.766612 0.479567 -0.080786
C -2.389190 -0.892858 -0.295959
C -4.493558 0.817999 0.074710
C 2.009794 1.898993 -0.110249
C 2.925217 -0.408021 0.072886
C 0.021000 -1.325077 -0.588921
C -0.396775 2.379128 0.032701
C -3.734713 -1.363979 -0.153205
C -1.293416 -1.765154 -0.641609
C -4.864149 -0.520457 0.132153
C 0.914609 2.824398 -0.044106
C 4.257687 0.136160 -0.097621
C 3.354657 2.409391 -0.224833
C 4.438140 1.555461 -0.282501
C 2.832918 -1.780001 0.481263
C 5.398721 -0.720891 -0.008320
C 3.967632 -2.595172 0.593859
C 5.262712 -2.075908 0.310184
H 0.807195 -2.001573 -0.931087
H -1.227767 3.087283 0.119472
H -1.490400 -2.780941 -1.009688
H 1.137236 3.897481 -0.044282
H 3.493098 3.494872 -0.286431
H 5.454613 1.943957 -0.413586
H 1.865603 -2.190615 0.779217
H 6.393111 -0.286369 -0.165844
H 3.857580 -3.634065 0.923865
H 6.143874 -2.722294 0.382457
H -3.322274 -3.327560 -0.115396
H -6.094172 -2.016075 0.320639


