BU4TY6
  -OEChem-04042102053D

 19 20  0     0  0  0  0  0  0999 V2000
   -3.4791   -0.0083    0.0010 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.2198   -1.8064   -0.0003 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2372   -0.4365   -0.0002 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4601   -1.6557   -0.0004 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.7879   -1.7024   -0.0001 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3478   -0.5560    0.0002 N   0  3  0  0  0  0  0  0  0  0  0  0
    1.2127    0.4654   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0816   -0.3392   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1883    0.2562   -0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1682    1.8580   -0.0004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2622    1.6552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1046    2.4395   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6543   -0.1698    0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0650    2.4664   -0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2224    2.1668    0.0002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1940    3.5231   -0.0005 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1701   -0.9855    0.5147 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9878   -0.1031   -1.0369 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8469    0.7683    0.5268 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  6  2  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7  8  2  0  0  0  0
  7 10  1  0  0  0  0
  8  9  1  0  0  0  0
  9 11  2  0  0  0  0
 10 12  2  0  0  0  0
 10 14  1  0  0  0  0
 11 12  1  0  0  0  0
 11 15  1  0  0  0  0
 12 16  1  0  0  0  0
 13 17  1  0  0  0  0
 13 18  1  0  0  0  0
 13 19  1  0  0  0  0
M  CHG  2   1  -1   6   1
M  END

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