A1JCS
  CCTOOLS-0612260951

 30 32  0  0  0  0  0  0  0  0999 V2000
   -3.6630    0.1080    0.0020 C   0  0  0  0  0
   -2.0650   -1.5530   -0.0490 C   0  0  0  0  0
   -1.0710   -0.5700   -0.0220 C   0  0  0  0  0
   -1.4670    0.7730    0.0190 C   0  0  0  0  0
   -0.2000    1.5880    0.0410 C   0  0  0  0  0
    2.3330    0.9630    0.0190 C   0  0  0  0  0
    3.0140    0.3440    1.2520 C   0  0  0  0  0
   -4.9980    0.4540    0.0090 N   0  0  0  0  0
   -3.3310   -1.1760   -0.0360 N   0  0  0  0  0
   -2.7470    1.0710    0.0300 N   0  0  0  0  0
    0.9080    0.6240    0.0100 N   0  0  0  0  0
    4.0990   -0.6160    0.7210 C   0  0  0  0  0
    4.4180   -0.0810   -0.6970 C   0  0  0  0  0
    3.0270    0.3570   -1.2190 C   0  0  0  0  0
    0.3980   -0.6200   -0.0260 C   0  0  0  0  0
    1.0590   -1.6400   -0.0570 O   0  0  0  0  0
   -1.8030   -2.6000   -0.0800 H   0  0  0  0  0
   -0.1560    2.2370   -0.8340 H   0  0  0  0  0
   -0.1530    2.1840    0.9520 H   0  0  0  0  0
    2.4600    2.0450    0.0260 H   0  0  0  0  0
    3.4720    1.1260    1.8570 H   0  0  0  0  0
    2.2840   -0.2080    1.8440 H   0  0  0  0  0
   -5.6790   -0.2360   -0.0140 H   0  0  0  0  0
   -5.2570    1.3890    0.0370 H   0  0  0  0  0
    4.9860   -0.5760    1.3520 H   0  0  0  0  0
    3.7140   -1.6340    0.6660 H   0  0  0  0  0
    5.0970    0.7700   -0.6450 H   0  0  0  0  0
    4.8340   -0.8700   -1.3230 H   0  0  0  0  0
    2.4690   -0.5040   -1.5860 H   0  0  0  0  0
    3.1320    1.1080   -2.0020 H   0  0  0  0  0
  1  9  2  0  0  0
  1 10  1  0  0  0
  2  3  2  0  0  0
  2 17  1  0  0  0
  3  4  1  0  0  0
  3 15  1  0  0  0
  4 10  2  0  0  0
  4  5  1  0  0  0
  5 11  1  0  0  0
  5 18  1  0  0  0
  5 19  1  0  0  0
  6  7  1  0  0  0
  6 14  1  0  0  0
  6 20  1  0  0  0
  7 12  1  0  0  0
  7 21  1  0  0  0
  7 22  1  0  0  0
  8  1  1  0  0  0
  8 23  1  0  0  0
  8 24  1  0  0  0
  9  2  1  0  0  0
 11  6  1  0  0  0
 11 15  1  0  0  0
 12 13  1  0  0  0
 12 25  1  0  0  0
 12 26  1  0  0  0
 13 14  1  0  0  0
 13 27  1  0  0  0
 13 28  1  0  0  0
 14 29  1  0  0  0
 14 30  1  0  0  0
 15 16  2  0  0  0
M  END
$$$$
