-ISIS-  11270914432D

 19 21  0  0  0  0  0  0  0  0999 V2000
    0.3417   -0.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2542   -0.8500    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.4833    1.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.3042    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4833    0.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1958    1.6250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0542    0.3792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500   -1.0208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9583   -0.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7667    1.6208    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7667   -0.0333    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0542    1.2083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1917    2.4500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1917   -0.0292    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9125    1.2167    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9583   -1.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7792   -0.3083    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7750   -1.7292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1917   -1.0167    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3 10  2  0  0  0  0
  4  1  2  0  0  0  0
  5 11  2  0  0  0  0
  6  3  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  4  1  0  0  0  0
 10 12  1  0  0  0  0
 11  7  1  0  0  0  0
 12  7  2  0  0  0  0
 13  6  2  0  0  0  0
 14  5  1  0  0  0  0
 15  6  1  0  0  0  0
 16  8  1  0  0  0  0
 17  9  1  0  0  0  0
 18 16  2  0  0  0  0
 19 17  2  0  0  0  0
  9  8  2  0  0  0  0
  3  5  1  0  0  0  0
 18 19  1  0  0  0  0
M  END