A1DN3
  CCTOOLS-0731261037

 31 33  0  0  0  0  0  0  0  0999 V2000
   -1.3180   -2.6730    0.3010 O   0  0  0  0  0
   -0.9930   -1.5500   -0.0310 C   0  0  0  0  0
    0.4350   -1.1540   -0.0070 C   0  0  0  0  0
    1.4330   -2.1440   -0.0150 C   0  0  0  0  0
    2.7030   -1.8110    0.0060 N   0  0  0  0  0
    3.0520   -0.5200    0.0350 C   0  0  0  0  0
    4.4040   -0.1360    0.0580 C   0  0  0  0  0
    4.7300    1.1850    0.0870 C   0  0  0  0  0
    3.7410    2.1690    0.0950 C   0  0  0  0  0
    2.4230    1.8380    0.0740 C   0  0  0  0  0
    2.0450    0.4810    0.0430 C   0  0  0  0  0
    0.7600    0.1270    0.0170 N   0  0  0  0  0
   -1.9310   -0.6670   -0.4270 N   0  0  0  0  0
   -3.3480   -1.0120   -0.3060 C   0  0  0  0  0
   -4.0170   -0.0760    0.7070 C   0  0  0  0  0
   -3.7890    1.6410    0.1580 S   0  0  0  0  0
   -1.9850    1.7480   -0.0360 C   0  0  0  0  0
   -1.5210    0.6300   -0.9680 C   0  0  0  0  0
    1.1530   -3.1860   -0.0390 H   0  0  0  0  0
    5.1810   -0.8860    0.0520 H   0  0  0  0  0
    5.7700    1.4750    0.1040 H   0  0  0  0  0
    4.0280    3.2100    0.1190 H   0  0  0  0  0
    1.6690    2.6110    0.0800 H   0  0  0  0  0
   -3.8330   -0.9040   -1.2760 H   0  0  0  0  0
   -3.4430   -2.0430    0.0350 H   0  0  0  0  0
   -5.0820   -0.3030    0.7650 H   0  0  0  0  0
   -3.5590   -0.2110    1.6870 H   0  0  0  0  0
   -1.7200    2.7150   -0.4640 H   0  0  0  0  0
   -1.5050    1.6330    0.9360 H   0  0  0  0  0
   -0.4350    0.6600   -1.0560 H   0  0  0  0  0
   -1.9690    0.7710   -1.9520 H   0  0  0  0  0
  1  2  2  0  0  0
  2  3  1  0  0  0
  2 13  1  0  0  0
  3  4  2  0  0  0
  3 12  1  0  0  0
  4  5  1  0  0  0
  4 19  1  0  0  0
  5  6  2  0  0  0
  6  7  1  0  0  0
  6 11  1  0  0  0
  7  8  2  0  0  0
  7 20  1  0  0  0
  8  9  1  0  0  0
  8 21  1  0  0  0
  9 10  2  0  0  0
  9 22  1  0  0  0
 10 11  1  0  0  0
 10 23  1  0  0  0
 11 12  2  0  0  0
 13 14  1  0  0  0
 13 18  1  0  0  0
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 15 26  1  0  0  0
 15 27  1  0  0  0
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 17 18  1  0  0  0
 17 28  1  0  0  0
 17 29  1  0  0  0
 18 30  1  0  0  0
 18 31  1  0  0  0
M  END
$$$$
