A1JFE
  CCTOOLS-0612260951

 32 32  0  0  0  0  0  0  0  0999 V2000
   -6.4330    1.2750    0.4040 C   0  0  0  0  0
    4.4660   -0.5360    0.4000 O   0  0  0  0  0
   -5.6030    0.1210   -0.1630 C   0  0  0  0  0
    3.9760    1.8930    0.0620 O   0  0  0  0  0
   -4.1280    0.3380    0.1810 C   0  0  0  0  0
   -3.2970   -0.8150   -0.3860 C   0  0  0  0  0
   -1.8450   -0.6020   -0.0480 C   0  0  0  0  0
    0.4400   -1.2460   -0.2310 C   0  0  0  0  0
    1.3080   -2.3010    0.0300 C   0  0  0  0  0
    2.6520   -2.0630    0.2400 C   0  0  0  0  0
    3.1460   -0.7680    0.1920 C   0  0  0  0  0
    1.9560    2.7050   -0.3740 O   0  0  0  0  0
    2.2770    0.3010   -0.0700 C   0  0  0  0  0
    2.7940    1.6800   -0.1220 C   0  0  0  0  0
    0.9190    0.0520   -0.2810 C   0  0  0  0  0
   -0.9210   -1.4980   -0.4480 N   0  0  0  0  0
   -1.5070    0.3760    0.5850 O   0  0  0  0  0
   -6.0940    2.2150   -0.0300 H   0  0  0  0  0
   -7.4840    1.1200    0.1600 H   0  0  0  0  0
   -6.3140    1.3100    1.4870 H   0  0  0  0  0
    5.0010   -0.5580   -0.4060 H   0  0  0  0  0
   -5.9430   -0.8190    0.2710 H   0  0  0  0  0
   -5.7220    0.0860   -1.2460 H   0  0  0  0  0
   -3.7880    1.2780   -0.2530 H   0  0  0  0  0
   -4.0090    0.3740    1.2640 H   0  0  0  0  0
   -3.6370   -1.7550    0.0480 H   0  0  0  0  0
   -3.4170   -0.8510   -1.4690 H   0  0  0  0  0
    0.9290   -3.3110    0.0690 H   0  0  0  0  0
    3.3200   -2.8870    0.4420 H   0  0  0  0  0
    2.3420    3.5920   -0.3990 H   0  0  0  0  0
    0.2430    0.8700   -0.4840 H   0  0  0  0  0
   -1.1980   -2.3180   -0.8860 H   0  0  0  0  0
  1  3  1  0  0  0
  1 18  1  0  0  0
  1 19  1  0  0  0
  1 20  1  0  0  0
  2 11  1  0  0  0
  2 21  1  0  0  0
  3  5  1  0  0  0
  3 22  1  0  0  0
  3 23  1  0  0  0
  5  6  1  0  0  0
  5 24  1  0  0  0
  5 25  1  0  0  0
  6  7  1  0  0  0
  6 26  1  0  0  0
  6 27  1  0  0  0
  7 16  1  0  0  0
  8  9  2  0  0  0
  8 15  1  0  0  0
  9 10  1  0  0  0
  9 28  1  0  0  0
 10 11  2  0  0  0
 10 29  1  0  0  0
 11 13  1  0  0  0
 12 14  1  0  0  0
 12 30  1  0  0  0
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 15 13  2  0  0  0
 15 31  1  0  0  0
 16  8  1  0  0  0
 16 32  1  0  0  0
 17  7  2  0  0  0
M  END
$$$$
