LKH4D9
  -OEChem-05032301453D

 20 21  0     0  0  0  0  0  0999 V2000
    2.0582    1.8010    0.0109 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6235    0.4235    0.0003 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3066   -0.1226   -0.0042 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3929    0.3852   -0.0015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5347   -0.4190    0.0005 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8728   -0.2342   -0.0017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8348    1.7378   -0.0029 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4738   -1.8171    0.0024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2106    1.7288   -0.0018 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9490   -1.6317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2075   -2.4090    0.0021 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0913    0.5572   -0.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2362    2.6373   -0.0049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5879    0.1212    0.0016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3736   -2.4232    0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8829   -2.1816    0.0004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9315    2.5341   -0.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1266   -3.4932    0.0036 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4277   -1.1269   -0.0117 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1717    0.4090    0.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  2  0  0  0  0
  2  5  1  0  0  0  0
  2  9  1  0  0  0  0
  2 14  1  0  0  0  0
  3 12  1  0  0  0  0
  3 19  1  0  0  0  0
  3 20  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  4  7  1  0  0  0  0
  5  8  2  0  0  0  0
  6 10  1  0  0  0  0
  6 12  1  0  0  0  0
  7  9  2  0  0  0  0
  7 13  1  0  0  0  0
  8 11  1  0  0  0  0
  8 15  1  0  0  0  0
  9 17  1  0  0  0  0
 10 11  2  0  0  0  0
 10 16  1  0  0  0  0
 11 18  1  0  0  0  0
M  END

$$$$