CBV
  CCTOOLS-0717261001

 35 36  0  0  1  0  0  0  0  0999 V2000
   -6.3610    0.1990   -0.3230 O   0  0  0  0  0
   -5.1610    1.2720   -0.2940 P   0  0  0  0  0
   -5.5530    2.5400   -1.2060 O   0  0  0  0  0
   -4.9320    1.7180    1.0980 O   0  0  0  0  0
   -3.8190    0.5920   -0.8680 O   0  0  0  0  0
   -3.4600   -0.4460    0.0450 C   0  0  0  0  0
   -2.1850   -1.1370   -0.4440 C   0  0  0  0  0
   -1.0660   -0.2260   -0.3850 O   0  0  0  0  0
   -1.8010   -2.2960    0.5020 C   0  0  0  0  0
   -2.2510   -3.5440   -0.0270 O   0  0  0  0  0
   -0.2550   -2.2500    0.5450 C   0  0  0  0  0
    0.2960   -3.4710    0.0460 O   0  0  0  0  0
    0.1090   -1.0660   -0.3780 C   0  0  0  0  0
    1.2570   -0.3340    0.1610 N   0  0  0  0  0
    1.1550    0.2900    1.3490 C   0  0  0  0  0
    0.1040    0.2380    1.9650 O   0  0  0  0  0
    2.1830    0.9630    1.8630 N   0  0  0  0  0
    3.3380    1.0350    1.2140 C   0  0  0  0  0
    4.3930    1.7340    1.7550 N   0  0  0  0  0
    3.4760    0.3980   -0.0370 C   0  0  0  0  0
    2.4240   -0.2880   -0.5430 C   0  0  0  0  0
    5.1110    0.4850   -0.9830 BR  0  0  0  0  0
   -6.4780   -0.0650   -1.2460 H   0  0  0  0  0
   -6.3600    2.9170   -0.8290 H   0  0  0  0  0
   -4.2680   -1.1750    0.1030 H   0  0  0  0  0
   -3.2850   -0.0180    1.0320 H   0  0  0  0  0
   -2.3200   -1.5060   -1.4610 H   0  0  0  0  0
   -2.2170   -2.1310    1.4960 H   0  0  0  0  0
   -1.9840   -4.2280    0.6030 H   0  0  0  0  0
    0.0930   -2.0620    1.5600 H   0  0  0  0  0
   -0.0160   -4.1770    0.6280 H   0  0  0  0  0
    0.3260   -1.4230   -1.3850 H   0  0  0  0  0
    4.2940    2.1740    2.6130 H   0  0  0  0  0
    5.2370    1.7810    1.2800 H   0  0  0  0  0
    2.5060   -0.7880   -1.4970 H   0  0  0  0  0
  1  2  1  0  0  0
  1 23  1  0  0  0
  2  3  1  0  0  0
  2  4  2  0  0  0
  2  5  1  0  0  0
  3 24  1  0  0  0
  5  6  1  0  0  0
  6  7  1  0  0  0
  6 25  1  0  0  0
  6 26  1  0  0  0
  7  8  1  0  0  0
  7  9  1  0  0  0
  7 27  1  0  0  0
  8 13  1  0  0  0
  9 10  1  0  0  0
  9 11  1  0  0  0
  9 28  1  0  0  0
 10 29  1  0  0  0
 11 12  1  0  0  0
 11 13  1  0  0  0
 11 30  1  0  0  0
 12 31  1  0  0  0
 13 14  1  0  0  0
 13 32  1  0  0  0
 14 15  1  0  0  0
 14 21  1  0  0  0
 15 16  2  0  0  0
 15 17  1  0  0  0
 17 18  2  0  0  0
 18 19  1  0  0  0
 18 20  1  0  0  0
 19 33  1  0  0  0
 19 34  1  0  0  0
 20 21  2  0  0  0
 20 22  1  0  0  0
 21 35  1  0  0  0
M  END
$$$$
