%chk=000059619.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059619

0 1
 I   0.2196000      -1.847400     -0.1861000    
 I   -5.118800       1.142600     -0.5554000    
 I  -3.2600001E-02   4.230800     -0.1388000    
 O    1.118000       1.214200     -8.6099997E-02
 O    3.620900      7.9999998E-02  0.4507000    
 O   -4.095200      -3.054400      0.7167000    
 O    6.805900      -1.197600     -0.5758000    
 O    4.715300      -2.071400     -0.8070000    
 N   -2.971100      -1.317200     -0.4164000    
 C   -2.298300     -8.8699996E-02 -0.3546000    
 C  -0.2437000       1.171600     -0.1876000    
 C  -0.9077000     -5.3599998E-02 -0.2498000    
 C   -3.024900       1.101200     -0.3972000    
 C    1.666100       1.222200       1.228600    
 C  -0.9704000       2.361500     -0.2302000    
 C   -2.360900       2.326200     -0.3350000    
 C    3.179500       1.247100       1.133700    
 C   -3.298700      -1.874900      -1.761700    
 C   -3.435100      -2.012800      0.7487000    
 C   -3.061600      -1.454600       2.102900    
 C    5.034800      6.1000001E-02  0.3129000    
 C    5.458900      -1.185800     -0.4125000    
 H    1.348700      0.3270000       1.773800    
 H    1.320600       2.098100       1.787100    
 H   -2.926500       3.255200     -0.3679000    
 H    3.616700       1.278100       2.137700    
 H    3.499700       2.131400      0.5707000    
 H   -2.872600      -2.880600      -1.826500    
 H   -2.892600      -1.242900      -2.556300    
 H   -4.385600      -1.955000      -1.852500    
 H   -3.371100     -0.4110000       2.191800    
 H   -1.986000      -1.538600       2.267600    
 H   -3.574300      -2.023600       2.884800    
 H    5.501000      6.3299999E-02   1.303800    
 H    5.357900      0.9301000     -0.2701000    
 H    7.110400      -2.001800      -1.047900    


%chk=000059619-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059619

0 1
I 0.583838 -1.441934 -0.280809
I -5.206362 0.773916 -0.378141
I -0.453482 4.582775 0.149040
O 1.092854 1.716703 -0.033118
O 3.567972 0.159619 0.881663
O -3.513812 -3.409704 0.380815
O 6.154179 -1.921031 -0.563753
O 3.910774 -2.402968 -0.175517
N -2.721593 -1.393843 -0.474213
C -2.211702 -0.068980 -0.281379
C -0.289334 1.490216 -0.038624
C -0.809559 0.171857 -0.184574
C -3.083047 1.056131 -0.235067
C 1.770073 1.711242 1.297398
C -1.199702 2.578023 -0.004648
C -2.591032 2.371334 -0.102224
C 3.263988 1.586637 1.039807
C -2.862200 -1.870553 -1.868244
C -3.068555 -2.245402 0.594397
C -2.871171 -1.685761 1.998505
C 4.807821 -0.104719 0.184340
C 4.847829 -1.584655 -0.176598
H 1.416986 0.852107 1.897072
H 1.537584 2.661878 1.814722
H -3.277592 3.219938 -0.079235
H 3.834071 2.003779 1.897713
H 3.523692 2.157854 0.123393
H -3.259075 -2.896978 -1.820282
H -1.881319 -1.879199 -2.377068
H -3.564300 -1.229462 -2.431399
H -3.437928 -0.749575 2.147955
H -1.804084 -1.476130 2.194868
H -3.224991 -2.440566 2.715511
H 5.704683 0.137631 0.793072
H 4.878660 0.474887 -0.763905
H 6.182138 -2.875368 -0.845373


