Ketcher 08292216232D 1   1.00000     0.00000     0

  7  6  0     0  0            999 V2000
    4.2012   -1.2574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2703    0.5944    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2012   -0.0228    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1320    0.5944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4691    0.9772    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5147    1.2574    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7492   -0.0684    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0     0  0
  2  3  2  0     0  0
  3  4  1  0     0  0
  4  5  1  0     0  0
  4  6  1  0     0  0
  4  7  1  0     0  0
M  CHG  2   1  -1   3   1
M  ISO  3   5   2   6   2   7   2
M  END