XYO
  CCTOOLS-1220241028

 28 29  0  0  0  0  0  0  0  0999 V2000
    3.1350   -0.3140   -0.0020 C   0  0  0  0  0
    1.0150   -2.1040   -0.0070 C   0  0  0  0  0
    3.3720   -1.6780    0.0030 C   0  0  0  0  0
   -6.5770    0.2340    0.0010 C   0  0  0  0  0
   -7.4550    1.4870   -0.0020 C   0  0  0  0  0
   -2.8260   -0.0490   -0.0010 C   0  0  0  0  0
   -2.2940    1.1580    0.0010 N   0  0  0  0  0
   -1.7620   -0.9780    0.0010 C   0  0  0  0  0
   -0.6220   -0.2250   -0.0020 C   0  0  0  0  0
   -1.0120    1.0820   -0.0010 N   0  0  0  0  0
   -4.2670   -0.3700    0.0010 C   0  0  0  0  0
    0.7690   -0.7300   -0.0000 C   0  0  0  0  0
   -4.6320   -1.5290    0.0050 O   0  0  0  0  0
    1.8390    0.1640   -0.0040 C   0  0  0  0  0
   -5.1780    0.6230   -0.0010 O   0  0  0  0  0
    4.5870    0.8970    0.0010 BR  0  0  0  0  0
    2.3140   -2.5690    0.0000 C   0  0  0  0  0
    0.1910   -2.8010   -0.0080 H   0  0  0  0  0
    4.3860   -2.0470    0.0080 H   0  0  0  0  0
   -6.7890   -0.3560    0.8930 H   0  0  0  0  0
   -6.7900   -0.3610   -0.8870 H   0  0  0  0  0
   -8.5050    1.1940   -0.0010 H   0  0  0  0  0
   -7.2420    2.0820    0.8860 H   0  0  0  0  0
   -7.2430    2.0760   -0.8940 H   0  0  0  0  0
   -1.8350   -2.0560    0.0050 H   0  0  0  0  0
   -0.4100    1.8420   -0.0010 H   0  0  0  0  0
    1.6550    1.2280   -0.0070 H   0  0  0  0  0
    2.5050   -3.6320   -0.0040 H   0  0  0  0  0
  1  3  2  0  0  0
  1 16  1  0  0  0
  2 17  2  0  0  0
  2 18  1  0  0  0
  3 19  1  0  0  0
  4  5  1  0  0  0
  4 20  1  0  0  0
  4 21  1  0  0  0
  5 22  1  0  0  0
  5 23  1  0  0  0
  5 24  1  0  0  0
  6 11  1  0  0  0
  6  8  1  0  0  0
  6  7  2  0  0  0
  7 10  1  0  0  0
  8  9  2  0  0  0
  8 25  1  0  0  0
  9 10  1  0  0  0
  9 12  1  0  0  0
 10 26  1  0  0  0
 11 15  1  0  0  0
 11 13  2  0  0  0
 12 14  2  0  0  0
 12  2  1  0  0  0
 14  1  1  0  0  0
 14 27  1  0  0  0
 15  4  1  0  0  0
 17  3  1  0  0  0
 17 28  1  0  0  0
M  END
$$$$
