%chk=000128598.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128598

0 1
 O   -2.396800      -2.550500     -0.3294000    
 O   -4.140100       3.458400      9.8600000E-02
 O   -2.937400      -2.133700       1.877600    
 O    6.924100     -0.1242000     -0.4472000    
 O    6.115500       1.049100       1.364200    
 C   -3.739500     -0.6438000      0.1127000    
 C   -2.813000      0.2754000     -0.7424000    
 C   -3.577500       1.524800      -1.252200    
 C   -4.405200      0.1413000       1.263500    
 C   -5.132300       1.397900      0.7956000    
 C   -4.242300       2.246300     -8.3700001E-02
 C   -4.813500      -1.235000     -0.7730000    
 C   -2.985300      -1.857300      0.6866000    
 C   -1.555000      0.6577000     -5.9000002E-03
 C   -2.707400       2.468900      -2.083900    
 C  -0.3217000      0.3251000     -0.4222000    
 C   0.9392000      0.6607000      0.2385000    
 C   -1.657300      -3.710500      6.5200001E-02
 C   0.8625000       1.460900       1.518700    
 C   -1.070400      -4.364100      -1.167800    
 C    2.156400      0.3005000     -0.2235000    
 C    3.459800      0.5798000      0.3510000    
 C    4.598800      0.1575000     -0.2187000    
 C    5.950500      0.4163000      0.3293000    
 C    8.265700      7.9000004E-02  9.3999999E-03
 C    9.222100     -0.5809000     -0.9611000    
 H   -2.513600     -0.2885000      -1.638600    
 H   -4.391700       1.205700      -1.914400    
 H   -3.645100      0.4315000       2.001000    
 H   -5.114100     -0.4980000       1.806000    
 H   -5.429900       1.989500       1.668800    
 H   -6.044300       1.160000      0.2399000    
 H   -5.528200     -0.5002000      -1.153200    
 H   -4.394900      -1.742000      -1.651100    
 H   -5.402400      -1.987900     -0.2331000    
 H   -1.686300       1.239600      0.9019000    
 H   -3.320700       3.261600      -2.527300    
 H   -2.216600       1.930400      -2.901200    
 H   -1.938000       2.961600      -1.480000    
 H  -0.2239000     -0.2549000      -1.338300    
 H  -0.8516000      -3.414700      0.7463000    
 H   -2.325500      -4.413600      0.5749000    
 H    1.808300       1.699600       2.003000    
 H   0.2732000      0.9154000       2.265700    
 H   0.3709000       2.422800       1.329300    
 H  -0.4966000      -5.256300     -0.9023000    
 H  -0.4141000      -3.665700      -1.697700    
 H   -1.863300      -4.648100      -1.867600    
 H    2.185700     -0.2767000      -1.148700    
 H    3.534100       1.146700       1.269700    
 H    4.569500     -0.4153000      -1.142700    
 H    8.474500       1.153200      6.2399998E-02
 H    8.383700     -0.3641000       1.004500    
 H    9.013700      -1.653100      -1.038500    
 H    9.103100     -0.1606000      -1.965200    
 H    10.25910     -0.4448000     -0.6418000    


%chk=000128598-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000128598

0 1
O -2.217191 -2.479626 -0.428300
O -4.184860 3.472496 0.252854
O -2.529268 -2.012942 1.826609
O 6.870167 -0.332808 -0.396882
O 6.091637 1.049855 1.325714
C -3.741581 -0.670663 0.107038
C -2.892217 0.332478 -0.784039
C -3.773498 1.559100 -1.231155
C -4.347557 0.069359 1.332274
C -5.155485 1.335605 0.939371
C -4.359480 2.248767 0.009444
C -4.846434 -1.365890 -0.740825
C -2.786539 -1.764259 0.626491
C -1.639693 0.793451 -0.065121
C -3.015976 2.527040 -2.155777
C -0.374109 0.418072 -0.426150
C 0.867074 0.806977 0.251283
C -1.229744 -3.537444 -0.044439
C 0.774960 1.711987 1.464196
C -0.741144 -4.177533 -1.339213
C 2.064621 0.314449 -0.251257
C 3.388561 0.561304 0.270863
C 4.538940 0.033161 -0.269611
C 5.854879 0.324891 0.321638
C 8.257781 -0.118588 0.106410
C 9.184155 -0.930309 -0.793564
H -2.591543 -0.215495 -1.697608
H -4.637484 1.135885 -1.786963
H -3.535860 0.350327 2.026501
H -4.998082 -0.625491 1.893973
H -5.444630 1.905127 1.839133
H -6.089194 1.038721 0.418557
H -5.607250 -0.645148 -1.087314
H -4.407903 -1.863886 -1.621686
H -5.367631 -2.132339 -0.138572
H -1.781108 1.460117 0.797955
H -3.682225 3.333953 -2.506282
H -2.618060 1.989592 -3.036122
H -2.171848 3.002995 -1.629372
H -0.261939 -0.243794 -1.299436
H -0.416367 -3.053970 0.526421
H -1.736213 -4.258716 0.621960
H 1.759964 1.966394 1.882148
H 0.182252 1.230313 2.264949
H 0.262627 2.658345 1.207761
H -0.008283 -4.972024 -1.108777
H -0.250177 -3.432866 -1.989306
H -1.578248 -4.629992 -1.897959
H 2.009939 -0.334260 -1.139267
H 3.512874 1.202492 1.153607
H 4.522701 -0.619029 -1.149573
H 8.478110 0.964327 0.074729
H 8.301208 -0.442710 1.162451
H 8.930373 -2.003544 -0.753863
H 9.109267 -0.593857 -1.841865
H 10.231631 -0.807696 -0.462432


