%chk=000011225.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011225

0 1
 O   0.8267000       2.686400     -0.4833000    
 O   -5.279600      0.5419000     -0.4569000    
 O   -5.948500      -1.362900       1.485700    
 O   -3.615300      -1.141300      -2.866900    
 O    6.104500      0.2511000     -0.3205000    
 O    7.578000      -1.476700     -0.2149000    
 C   0.3926000       1.358100     -7.7299997E-02
 C    1.412000      0.2610000     -0.3763000    
 C   -1.076200       1.179800     -0.4086000    
 C    1.014900       2.339300      0.8779000    
 C   -1.560300     -0.2787000     -0.1934000    
 C    2.468400      0.4381000      0.7878000    
 C    2.418700       1.927800       1.188500    
 C   0.7956000      -1.148800     -0.2725000    
 C   -3.063500     -0.4656000     -0.6081000    
 C  -0.5914000      -1.249300     -0.8991000    
 C   -1.974100       2.164200      0.3565000    
 C   -3.969500      0.5723000      0.1323000    
 C    2.011000      0.4665000      -1.783000    
 C   -3.443700       2.012200     -1.3000000E-02
 C   -3.602700      -1.897000     -0.3343000    
 C    3.853000     -4.6700001E-02  0.5040000    
 C   -4.131600      0.2180000       1.636700    
 C   -3.176500     -0.2808000      -2.111000    
 C   -3.717800      -2.230500       1.151300    
 C   -4.589000      -1.220700       1.890900    
 C    4.190600      -1.403300      0.8484000    
 C    4.805400      0.7069000     -5.4800000E-02
 C    5.414900      -1.886200      0.6157000    
 C    6.453500      -1.035100     -1.7000000E-03
 H   -1.158200       1.418500      -1.476500    
 H   0.4588000       2.831000       1.655900    
 H   -1.480600     -0.4864000      0.8823000    
 H    2.092200     -8.9800000E-02   1.678200    
 H    2.633500       2.046600       2.256400    
 H    3.102900       2.580000      0.6399000    
 H   0.6976000      -1.448300      0.7793000    
 H    1.459300      -1.891100     -0.7329000    
 H  -0.5405000      -1.044500      -1.974100    
 H  -0.9234000      -2.284900     -0.7856000    
 H   -1.672100       3.196800      0.1429000    
 H   -1.844900       2.028700       1.436700    
 H    2.556100       1.412900      -1.864300    
 H    2.699000     -0.3414000      -2.054000    
 H    1.221900      0.4919000      -2.543000    
 H   -4.049000       2.694100      0.5983000    
 H   -3.594800       2.358000      -1.044000    
 H   -2.980700      -2.658800     -0.8172000    
 H   -4.595500      -2.029900     -0.7860000    
 H   -4.876000      0.8947000       2.076800    
 H   -3.189700      0.3762000       2.172400    
 H   -2.867800      0.6928000      -2.522000    
 H   -4.147800      -3.234600       1.249600    
 H   -2.721000      -2.264500       1.604700    
 H   -4.555300      -1.422900       2.967400    
 H   -5.707600     -0.3020000     -0.2414000    
 H    3.435800      -2.037300       1.301400    
 H    4.720300       1.729100     -0.3905000    
 H   -6.218200      -2.277100       1.677500    
 H    5.676600      -2.906400      0.8715000    


%chk=000011225-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011225

0 1
O 1.357497 2.084156 0.119231
O -5.107898 0.887814 -0.978202
O -6.326425 -0.383558 1.073678
O -2.003675 -0.784173 -2.850815
O 5.480580 1.749770 -0.786278
O 7.668243 1.255845 -1.407319
C 0.572868 0.776269 0.198444
C 1.452304 -0.463548 -0.059530
C -0.838837 0.805056 -0.372655
C 1.036303 1.439183 1.459339
C -1.618635 -0.482360 0.055574
C 2.704487 -0.294142 0.916388
C 2.215209 0.682137 2.048747
C 0.614824 -1.686743 0.437595
C -3.046058 -0.496291 -0.596790
C -0.790697 -1.772257 -0.199078
C -1.621604 2.079301 0.018840
C -3.860974 0.813124 -0.187224
C 1.834967 -0.619456 -1.546719
C -3.050725 2.070900 -0.563724
C -3.896388 -1.749162 -0.188806
C 4.030023 0.113861 0.277914
C -4.233807 0.792874 1.320264
C -3.008457 -0.543458 -2.134594
C -4.255337 -1.762719 1.313891
C -4.992835 -0.478165 1.742460
C 5.114423 -0.835591 0.185394
C 4.275086 1.378816 -0.228701
C 6.342300 -0.511752 -0.368023
C 6.625179 0.811374 -0.893805
H -0.739620 0.786691 -1.476412
H 0.391501 2.052513 2.097646
H -1.753117 -0.409011 1.158438
H 2.889050 -1.289017 1.366900
H 1.869443 0.116331 2.935666
H 3.020309 1.359640 2.383476
H 0.510248 -1.626112 1.542278
H 1.178733 -2.615961 0.221408
H -0.710604 -1.951520 -1.283933
H -1.314694 -2.646424 0.234445
H -1.071255 2.968505 -0.336650
H -1.670818 2.163336 1.124208
H 2.343336 0.284673 -1.921576
H 2.521205 -1.475064 -1.688430
H 0.945005 -0.790539 -2.176776
H -3.613783 2.963144 -0.231121
H -3.009975 2.122525 -1.669790
H -3.357426 -2.675523 -0.454595
H -4.831428 -1.747265 -0.782302
H -4.869953 1.674072 1.526496
H -3.334474 0.883229 1.954079
H -4.007444 -0.362154 -2.596480
H -4.881227 -2.649550 1.541228
H -3.340743 -1.861266 1.930785
H -5.155512 -0.475623 2.839278
H -5.835207 0.458020 -0.436997
H 4.956200 -1.850441 0.573073
H 3.532398 2.180826 -0.245518
H -6.858962 -1.196849 1.256064
H 7.157871 -1.236894 -0.430583


