A1JUV
  CCTOOLS-0327261008

 29 30  0  0  0  0  0  0  0  0999 V2000
    0.1070   -2.9460   -0.0470 O   0  0  0  0  0
    0.5580   -1.8140   -0.0250 C   0  0  0  0  0
    1.8890   -1.6280   -0.0690 N   0  0  0  0  0
    2.4340   -0.3620   -0.0460 C   0  0  0  0  0
    3.8150   -0.1860   -0.0930 C   0  0  0  0  0
    4.3460    1.0850   -0.0690 C   0  0  0  0  0
    3.5170    2.1960    0.0020 C   0  0  0  0  0
    2.1610    2.0490    0.0490 C   0  0  0  0  0
    1.5980    0.7670    0.0250 C   0  0  0  0  0
    0.1460    0.5870    0.0750 C   0  0  0  0  0
   -0.3560   -0.6750    0.0440 C   0  0  0  0  0
   -1.7000   -0.8780    0.0890 O   0  0  0  0  0
   -2.5290    0.2830    0.1690 C   0  0  0  0  0
   -3.9990   -0.1420    0.2090 C   0  0  0  0  0
   -4.8730    1.0820    0.2940 C   0  0  0  0  0
   -5.8190    1.2740   -0.5920 C   0  0  0  0  0
    2.4760   -2.3990   -0.1190 H   0  0  0  0  0
    4.4680   -1.0450   -0.1470 H   0  0  0  0  0
    5.4170    1.2170   -0.1050 H   0  0  0  0  0
    3.9500    3.1860    0.0200 H   0  0  0  0  0
    1.5230    2.9190    0.1040 H   0  0  0  0  0
   -0.5130    1.4410    0.1300 H   0  0  0  0  0
   -2.2870    0.8410    1.0730 H   0  0  0  0  0
   -2.3570    0.9130   -0.7040 H   0  0  0  0  0
   -4.2410   -0.7000   -0.6950 H   0  0  0  0  0
   -4.1710   -0.7720    1.0820 H   0  0  0  0  0
   -4.7200    1.8020    1.0840 H   0  0  0  0  0
   -6.4460    2.1510   -0.5320 H   0  0  0  0  0
   -5.9720    0.5540   -1.3830 H   0  0  0  0  0
  2  1  2  0  0  0
  3  2  1  0  0  0
  3 17  1  0  0  0
  4  3  1  0  0  0
  5  4  1  0  0  0
  5 18  1  0  0  0
  6  5  2  0  0  0
  6 19  1  0  0  0
  7  8  2  0  0  0
  7  6  1  0  0  0
  7 20  1  0  0  0
  8  9  1  0  0  0
  8 21  1  0  0  0
  9 10  1  0  0  0
  9  4  2  0  0  0
 10 11  2  0  0  0
 10 22  1  0  0  0
 11 12  1  0  0  0
 11  2  1  0  0  0
 13 14  1  0  0  0
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 13 23  1  0  0  0
 13 24  1  0  0  0
 14 15  1  0  0  0
 14 25  1  0  0  0
 14 26  1  0  0  0
 15 27  1  0  0  0
 16 15  2  0  0  0
 16 28  1  0  0  0
 16 29  1  0  0  0
M  END
$$$$
