BKET41
  -OEChem-04012115253D

 21 21  0     0  0  0  0  0  0999 V2000
    1.7381    0.3716   -0.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4588   -1.9040    0.0004 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0012    0.7475   -0.0012 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1192    1.7747    0.0011 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4558   -0.5099   -0.0002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3684    0.6550   -0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4907   -1.4187    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7008   -0.6818    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9498   -0.7655   -0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1583    0.1875    0.0003 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8312    1.5435    0.0001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4778    1.6124   -0.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3919   -2.4957    0.0007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7042   -1.0850    0.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4515   -0.3729    0.8947 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4519   -0.3733   -0.8937 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9198    1.4400    0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5311    2.1224   -0.8796 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5306    2.1229    0.8793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7115    2.7047    0.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1339    1.7405    0.0023 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  9  2  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  3 12  1  0  0  0  0
  4  6  1  0  0  0  0
  4 20  1  0  0  0  0
  4 21  1  0  0  0  0
  5  7  2  0  0  0  0
  5  9  1  0  0  0  0
  6  8  2  0  0  0  0
  7  8  1  0  0  0  0
  7 13  1  0  0  0  0
  8 14  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  1  0  0  0  0
 10 16  1  0  0  0  0
 11 17  1  0  0  0  0
 11 18  1  0  0  0  0
 11 19  1  0  0  0  0
M  END

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