BDT2V9
  -OEChem-04022112523D

 49 49  0     1  0  0  0  0  0999 V2000
   -0.7518   -3.9043    0.6492 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8640   -2.4183   -1.3670 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -3.4139    2.4727   -1.1164 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6881   -2.7713    1.4097 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0939   -0.6511    0.1199 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4749   -0.1002    0.3139 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9415   -0.4950   -1.0937 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6231    1.4112    0.5348 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0308   -0.5405    0.5468 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3657   -0.0184   -1.3699 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0477    1.8847    0.2558 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5111    1.4828   -1.1410 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8294   -2.0674    0.4498 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.6311   -2.4908    0.7140 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.5946   -1.8751   -0.2975 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -4.4450   -0.2426   -0.3610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7925    1.6261   -0.4822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5740    3.2774    0.6972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5027    3.3956    1.7600 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1302   -0.5887    1.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2653   -0.0714   -1.8472 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9297   -1.5815   -1.2252 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3616    1.6626    1.5689 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9307    1.9534   -0.1212 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4005   -0.0352   -0.1933 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6999   -0.1933    1.5347 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6421   -0.2616   -2.4021 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0639   -0.5565   -0.7169 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7274    1.4571    1.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1008    2.9741    0.3625 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5569    1.7780   -1.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9217    2.0248   -1.8908 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0926   -2.4190   -0.5541 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9368   -2.1951    1.7250 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6645   -2.6778    1.1349 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4858   -3.7702    1.3788 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4100   -4.1948   -0.2136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8278   -0.2889    1.0311 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7945   -0.0781   -1.7347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6847   -0.0314    0.6875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1477    0.3238   -0.9813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6229   -1.3093   -0.5348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2297    3.7490   -0.2299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4901    3.7717    1.0392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8161    2.8945    2.6818 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4174    2.9111    1.4322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2874    4.4444    1.9827 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  1 39  1  0  0  0  0
  2 16  2  0  0  0  0
  3 19  1  0  0  0  0
  3 20  1  0  0  0  0
  4 19  2  0  0  0  0
  5 14  1  0  0  0  0
  5 37  1  0  0  0  0
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  9 26  1  0  0  0  0
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M  END

$$$$