A1JBN
  CCTOOLS-0424261114

 36 37  0  0  1  0  0  0  0  0999 V2000
   -0.9790   -1.3170    0.4010 C   0  0  0  0  0
   -2.3920   -1.6000   -0.1180 C   0  0  0  0  0
   -3.2780   -0.3800    0.1540 C   0  0  0  0  0
   -2.6530    0.8520   -0.5050 C   0  0  0  0  0
   -3.5000    2.0860   -0.1870 C   0  0  0  0  0
   -0.4430   -0.0490   -0.2680 C   0  0  0  0  0
   -0.1260   -2.4210    0.0880 O   0  0  0  0  0
   -2.9290   -2.7410    0.5550 O   0  0  0  0  0
   -4.5800   -0.6040   -0.3900 O   0  0  0  0  0
   -1.3290    1.0400   -0.0010 O   0  0  0  0  0
   -2.9840    3.2140   -0.8960 O   0  0  0  0  0
    0.8860    0.2600    0.2660 N   0  3  0  0  0
    1.9500   -0.0740   -0.4350 C   0  0  0  0  0
    3.2310    0.2060    0.0440 C   0  0  0  0  0
    3.3650    0.8480    1.2820 C   0  0  0  0  0
    2.2160    1.1780    1.9770 C   0  0  0  0  0
    0.9820    0.8710    1.4310 C   0  0  0  0  0
    4.4250   -0.1700   -0.7410 C   0  0  0  0  0
    4.2970   -0.7270   -1.8120 O   0  0  0  0  0
    5.6560    0.1050   -0.2680 O   0  0  0  0  0
   -1.0090   -1.1750    1.4810 H   0  0  0  0  0
   -2.3550   -1.7930   -1.1900 H   0  0  0  0  0
   -3.3550   -0.2190    1.2300 H   0  0  0  0  0
   -2.6140    0.7060   -1.5840 H   0  0  0  0  0
   -4.5310    1.9060   -0.4910 H   0  0  0  0  0
   -3.4660    2.2830    0.8850 H   0  0  0  0  0
   -0.3750   -0.2070   -1.3440 H   0  0  0  0  0
   -0.4100   -3.2590    0.4770 H   0  0  0  0  0
   -3.8240   -2.9770    0.2750 H   0  0  0  0  0
   -5.0340   -1.3740   -0.0200 H   0  0  0  0  0
   -3.4730    4.0330   -0.7420 H   0  0  0  0  0
    1.8310   -0.5690   -1.3870 H   0  0  0  0  0
    4.3410    1.0770    1.6840 H   0  0  0  0  0
    2.2810    1.6740    2.9340 H   0  0  0  0  0
    0.0830    1.1270    1.9720 H   0  0  0  0  0
    6.4060   -0.1600   -0.8170 H   0  0  0  0  0
  1  2  1  0  0  0
  1 21  1  0  0  0
  2  8  1  0  0  0
  2  3  1  0  0  0
  2 22  1  0  0  0
  3  4  1  0  0  0
  3  9  1  0  0  0
  3 23  1  0  0  0
  4  5  1  0  0  0
  4 24  1  0  0  0
  5 11  1  0  0  0
  5 26  1  0  0  0
  5 25  1  0  0  0
  6  1  1  0  0  0
  6 10  1  0  0  0
  6 27  1  0  0  0
  7  1  1  0  0  0
  7 28  1  0  0  0
  8 29  1  0  0  0
  9 30  1  0  0  0
 10  4  1  0  0  0
 11 31  1  0  0  0
 12  6  1  0  0  0
 13 12  1  0  0  0
 13 32  1  0  0  0
 14 13  2  0  0  0
 15 16  2  0  0  0
 15 14  1  0  0  0
 15 33  1  0  0  0
 16 17  1  0  0  0
 16 34  1  0  0  0
 17 12  2  0  0  0
 17 35  1  0  0  0
 18 14  1  0  0  0
 18 20  1  0  0  0
 19 18  2  0  0  0
 20 36  1  0  0  0
M  CHG  1  12   1
M  END
$$$$
