TOX
  Mrv0541 02241214132D          

 17 18  0  0  0  0            999 V2000
   -1.6942   -0.4694    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5012   -0.6410    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.0532   -0.0279    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7983    0.7568    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2832    1.4242    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7983    2.0916    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0137    1.8367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0137    1.0117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2992    0.5992    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5847    1.0117    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5847    1.8367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2992    2.2492    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7561   -1.4256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2041   -2.0387    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5012    3.4893    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0532    2.8763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1105   -1.0749    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2 17  1  1  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  5  6  1  0  0  0  0
  6 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7 12  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 13 14  1  0  0  0  0
 15 16  1  0  0  0  0
M  END