Mrv0541 04272421542D          

 17 19  0  0  0  0            999 V2000
    4.6628    2.8795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0988    2.2774    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2953    2.4648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7313    1.8627    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9279    2.0501    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6885    2.8396    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2525    3.4417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0559    3.2543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6199    3.8564    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4234    3.6690    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8636    2.8559    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5933    2.0765    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2316    2.0927    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4710    2.8822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2059    3.3539    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2504    3.1526    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.2510    1.5785    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  3  8  4  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  6 11  1  0  0  0  0
 11 12  4  0  0  0  0
 12 13  4  0  0  0  0
 13 14  4  0  0  0  0
 14 15  4  0  0  0  0
 11 15  4  0  0  0  0
 14 16  1  0  0  0  0
 12 17  1  0  0  0  0
  5 17  1  0  0  0  0
M  END