DR4455
  -OEChem-08132116283D

 31 32  0     1  0  0  0  0  0999 V2000
    1.8038   -0.5758   -0.9384 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2413    2.3483    1.0750 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4438    1.9512   -0.4665 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3714   -2.7983   -0.2557 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6479    1.8513   -0.7048 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4979    0.9507   -0.2763 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3903   -0.0742   -0.1870 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9692   -1.5408    0.3612 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7666   -1.2014    0.4250 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6306    1.0169    0.8057 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.0922    0.8916    0.4232 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.9448    0.4652   -0.4348 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.1151   -0.4251   -0.3467 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3804   -1.6297    0.5455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5812    0.5863   -0.3185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6761   -1.3486    0.2233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5392   -0.3387    0.0245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9551   -0.1289    0.0454 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4135    0.4027    1.6872 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7709    0.9342    1.2798 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8591    1.2094   -1.2342 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8322   -0.4106   -1.1752 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6121   -1.7490    1.3159 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3574   -1.5525    1.0314 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4860    2.8940    0.3083 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3705    1.8145   -0.7280 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0886   -2.0899    0.4108 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000   -2.8533   -0.6841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7580    2.2370   -0.7329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3803   -2.1028    0.6869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7765   -1.1081    0.4491 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2 10  1  0  0  0  0
  2 25  1  0  0  0  0
  3 11  1  0  0  0  0
  3 26  1  0  0  0  0
  4 14  1  0  0  0  0
  4 28  1  0  0  0  0
  5 15  1  0  0  0  0
  5 29  1  0  0  0  0
  6 18  2  0  0  0  0
  7 12  1  0  0  0  0
  7 15  1  0  0  0  0
  7 16  1  0  0  0  0
  8 16  2  0  0  0  0
  8 17  1  0  0  0  0
  9 18  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 19  1  0  0  0  0
 11 13  1  0  0  0  0
 11 20  1  0  0  0  0
 12 21  1  0  0  0  0
 13 14  1  0  0  0  0
 13 22  1  0  0  0  0
 14 23  1  0  0  0  0
 14 24  1  0  0  0  0
 15 17  2  0  0  0  0
 16 27  1  0  0  0  0
 17 18  1  0  0  0  0
M  END

$$$$