%chk=000016654.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016654

0 1
 O   -2.275400     -0.6554000      0.9211000    
 O    2.283000     -0.6722000     -0.8923000    
 O   -2.806100     -0.2932000     -0.3854000    
 O    2.810800     -0.2543000      0.3934000    
 C   -1.976900      0.5788000       1.557300    
 C    1.934700      0.5647000      -1.556100    
 C  -0.9496000       1.337800      0.7216000    
 C   0.9171000       1.313400     -0.7638000    
 C  -2.1500001E-02  0.6196000     -1.9999999E-04
 C   -1.386800      0.2680000       2.937900    
 C   -3.316400       1.315000       1.707400    
 C    1.374800      0.1808000      -2.944500    
 C    3.284200       1.302900      -1.748900    
 C  -0.9860000       2.715000      0.7182000    
 C   0.9040000       2.708000     -0.7865000    
 C   -3.104900      -1.536500      -1.021500    
 C    3.156900      -1.462000       1.055800    
 C  -4.7499999E-02   3.408800     -4.5400001E-02
 C   -1.812600      -2.342100      -1.146100    
 C   -4.132600      -2.282800     -0.1721000    
 C   -3.676200      -1.221200      -2.402200    
 C    4.202000      -2.194800      0.2157000    
 C    3.730000      -1.089800       2.421500    
 C    1.894800      -2.308400       1.215100    
 H  -9.3000000E-03 -0.4623000      2.5599999E-02
 H   -2.092300     -0.3193000       3.537000    
 H   -1.139600       1.181000       3.490600    
 H  -0.4766000     -0.3363000       2.856000    
 H   -4.081300      0.6405000       2.111900    
 H   -3.244300       2.167800       2.391400    
 H   -3.704700       1.687000      0.7519000    
 H    2.103700     -0.4150000      -3.505800    
 H    1.118200       1.066900      -3.535100    
 H   0.4760000     -0.4377000      -2.850900    
 H    3.677500       1.704600     -0.8077000    
 H    3.195400       2.136500      -2.454100    
 H    4.045600      0.6183000      -2.142100    
 H   -1.699700       3.292200       1.294600    
 H    1.608500       3.282200      -1.379500    
 H  -5.7100002E-02   4.494800     -6.2500000E-02
 H   -1.383400      -2.607600     -0.1740000    
 H   -1.986600      -3.277300      -1.690000    
 H   -1.049500      -1.776600      -1.688700    
 H   -5.000300      -1.646500      3.6699999E-02
 H   -4.483400      -3.187300     -0.6809000    
 H   -3.728800      -2.590900      0.7986000    
 H   -3.928400      -2.132200      -2.954600    
 H   -4.578500     -0.6046000      -2.318500    
 H   -2.960100     -0.6417000      -2.996300    
 H    5.044000      -1.534100     -2.1000000E-02
 H    3.800400      -2.546200     -0.7411000    
 H    4.590800      -3.070900      0.7462000    
 H    4.019300      -1.976200       2.995300    
 H    4.609300     -0.4447000       2.312100    
 H    2.999700     -0.5199000       3.007700    
 H    1.114600      -1.751700       1.743400    
 H    2.104600      -3.218700       1.787800    
 H    1.468900      -2.620300      0.2554000    


%chk=000016654-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000016654

0 1
O -2.196082 -0.561904 0.991560
O 2.209115 -0.554942 -0.965730
O -2.821149 -0.437551 -0.428393
O 2.787393 -0.390313 0.470116
C -2.049393 0.827353 1.506335
C 2.058384 0.817830 -1.520086
C -1.035848 1.621987 0.660894
C 1.001625 1.617840 -0.734170
C 0.000357 0.932831 -0.009766
C -1.451547 0.543476 2.910784
C -3.438508 1.489257 1.614112
C 1.518244 0.488231 -2.937853
C 3.438860 1.503272 -1.591594
C -1.066844 3.036729 0.597517
C 0.959582 3.033599 -0.784057
C -3.087690 -1.829452 -0.902284
C 3.110643 -1.764586 0.961151
C -0.071496 3.734929 -0.121571
C -1.768550 -2.625154 -0.991997
C -4.118193 -2.517743 0.016926
C -3.673890 -1.543022 -2.303141
C 4.198511 -2.406501 0.075225
C 3.643203 -1.440606 2.375167
C 1.830840 -2.624975 1.020489
H 0.027432 -0.158510 0.031731
H -2.151570 -0.059875 3.515103
H -1.263124 1.500748 3.427312
H -0.492408 0.005378 2.820266
H -4.119581 0.809264 2.154578
H -3.386538 2.439869 2.173674
H -3.857310 1.683736 0.614004
H 2.251150 -0.115913 -3.500950
H 1.330886 1.428503 -3.485042
H 0.566914 -0.066618 -2.868595
H 3.819132 1.718604 -0.580505
H 3.388130 2.445955 -2.164298
H 4.150522 0.829735 -2.100010
H -1.859969 3.600528 1.100125
H 1.723196 3.595482 -1.332880
H -0.099989 4.829823 -0.166024
H -1.322707 -2.748915 0.008971
H -1.953956 -3.626563 -1.422096
H -1.041412 -2.094264 -1.631986
H -5.050124 -1.926663 0.059656
H -4.358610 -3.528302 -0.361574
H -3.717417 -2.609671 1.040058
H -3.927588 -2.498148 -2.797125
H -4.589737 -0.931568 -2.227318
H -2.941467 -1.004846 -2.929420
H 5.099400 -1.768213 0.049878
H 3.829180 -2.528679 -0.956523
H 4.480905 -3.399686 0.470239
H 3.919064 -2.379706 2.887552
H 4.535949 -0.793878 2.319859
H 2.871807 -0.925448 2.973539
H 1.063656 -2.133678 1.645259
H 2.056510 -3.617039 1.452925
H 1.414505 -2.768130 0.009384


