09X
  CCTOOLS-0919241028

 26 26  0  0  1  0  0  0  0  0999 V2000
   -2.2920    1.6170    0.0850 C   0  0  0  0  0
   -3.3620    0.6670   -0.4980 C   0  0  0  0  0
   -2.7940   -0.7450   -0.2330 C   0  0  0  0  0
   -3.9220   -1.7120    0.1330 C   0  0  0  0  0
    2.2100    0.0640   -0.9890 C   0  0  0  0  0
    1.1230    0.2640    0.0350 C   0  0  0  0  0
    1.3910    0.2370    1.2180 O   0  0  0  0  0
   -0.1480    0.4730   -0.3630 N   0  0  0  0  0
   -1.2050    0.6670    0.6330 C   0  0  0  0  0
   -1.8940   -0.5770    0.8840 O   0  0  0  0  0
   -3.3930   -3.0340    0.2600 O   0  0  0  0  0
   -3.5180    0.8890   -1.9010 O   0  0  0  0  0
   -2.8460    2.4090    1.1370 O   0  0  0  0  0
   -1.8820    2.2560   -0.6970 H   0  0  0  0  0
   -4.3130    0.8000    0.0180 H   0  0  0  0  0
   -2.2530   -1.1070   -1.1070 H   0  0  0  0  0
   -4.3690   -1.4080    1.0790 H   0  0  0  0  0
   -4.6810   -1.6980   -0.6490 H   0  0  0  0  0
    3.9290   -0.2120   -0.0750 BR  0  0  0  0  0
    1.9780   -0.8090   -1.5990 H   0  0  0  0  0
    2.2750    0.9460   -1.6270 H   0  0  0  0  0
   -0.3630    0.4940   -1.3080 H   0  0  0  0  0
   -0.7850    1.0620    1.5590 H   0  0  0  0  0
   -4.0540   -3.7010    0.4910 H   0  0  0  0  0
   -3.8150    1.7810   -2.1280 H   0  0  0  0  0
   -2.2170    3.0240    1.5390 H   0  0  0  0  0
  1  2  1  0  0  0
  1 14  1  0  0  0
  2  3  1  0  0  0
  2 12  1  0  0  0
  2 15  1  0  0  0
  3  4  1  0  0  0
  3 16  1  0  0  0
  4 17  1  0  0  0
  4 18  1  0  0  0
  5  6  1  0  0  0
  5 19  1  0  0  0
  5 20  1  0  0  0
  5 21  1  0  0  0
  6  8  1  0  0  0
  7  6  2  0  0  0
  8  9  1  0  0  0
  8 22  1  0  0  0
  9 10  1  0  0  0
  9  1  1  0  0  0
  9 23  1  0  0  0
 10  3  1  0  0  0
 11  4  1  0  0  0
 11 24  1  0  0  0
 12 25  1  0  0  0
 13  1  1  0  0  0
 13 26  1  0  0  0
M  END
$$$$