BEUG91
  -OEChem-04042105483D

 28 29  0     0  0  0  0  0  0999 V2000
    4.5532    1.2602    0.3387 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0429   -2.5403    0.4361 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8458   -1.3953   -0.3419 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8499    0.3720   -0.5738 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4488    0.2118    0.5157 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7519   -0.2718   -0.0649 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5120    0.5903   -0.3429 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3932   -0.4899   -0.2935 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2292    1.0267    0.1142 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9892    1.8886   -0.1638 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3478    2.1068    0.0647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8176   -0.0073    0.2842 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6552   -1.4130   -0.0171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2884   -1.3046    0.1063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6916    1.0742    0.2341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6468   -1.5224   -0.1243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0500    0.8562    0.0037 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5274   -0.4421   -0.1755 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0022   -1.4929   -0.4496 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3105    2.7368   -0.2016 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7057    3.1237    0.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6093   -2.1521    0.1454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3281    2.0888    0.3732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0187   -2.5332   -0.2637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7360    1.6973   -0.0361 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5851   -0.6118   -0.3549 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6945    2.2174    0.4382 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6584   -3.3036    0.4652 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 27  1  0  0  0  0
  2 13  1  0  0  0  0
  2 28  1  0  0  0  0
  3 13  2  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5 12  1  0  0  0  0
  6  8  1  0  0  0  0
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  6 13  1  0  0  0  0
  7  8  2  0  0  0  0
  7 10  1  0  0  0  0
  8 19  1  0  0  0  0
  9 11  1  0  0  0  0
 10 11  2  0  0  0  0
 10 20  1  0  0  0  0
 11 21  1  0  0  0  0
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 17 25  1  0  0  0  0
 18 26  1  0  0  0  0
M  END

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