LDPC0228.sdf
  ChemDraw04242410462D

 51 56  0  0  1  0  0  0  0  0999 V2000
   -5.3475    1.2283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3475    0.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6342   -0.0073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9211    0.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9211    1.2283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6342    1.6400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0609    1.6400    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2077   -0.0073    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4944    0.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7854   -0.0144    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0680    0.4047    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0680    1.2283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7854    1.6474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4944    1.2283    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7854    2.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4944    2.8755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2036    2.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2036    1.6474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3587    1.6474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3587    2.4710    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0721    2.8827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0721    3.7063    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3546    1.2354    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3546    2.8827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0677    2.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810    2.8827    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4944    2.4710    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2077    2.8827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4944    1.6474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2077    1.2354    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9208    1.6474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9208    2.4710    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6342    1.2354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6342    0.4118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3475    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0609   -0.4118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810    1.2354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810    0.4118    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0677    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0677   -0.8235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810   -1.2354    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4944   -0.8235    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4944    0.0001    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7810   -2.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0677   -2.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4944   -2.4707    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3546   -2.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3587   -2.4707    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3587   -3.2944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3546   -3.7063    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0677   -3.2944    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0      
  2  3  1  0      
  3  4  2  0      
  4  5  1  0      
  5  6  2  0      
  6  1  1  0      
  1  7  1  0      
  4  8  1  0      
  8  9  1  0      
  9 10  2  0      
 10 11  1  0      
 11 12  2  0      
 12 13  1  0      
 13 14  2  0      
 14  9  1  0      
 13 15  1  0      
 15 16  2  0      
 16 17  1  0      
 17 18  2  0      
 18 14  1  0      
 12 19  1  0      
 19 20  1  0      
 20 21  1  0      
 21 15  1  0      
 21 22  2  0      
 19 23  2  0      
 20 24  1  0      
 24 25  1  0      
 25 26  1  0      
 26 27  1  0      
 27 28  2  0      
 27 29  1  0      
 30 31  1  0      
 31 32  2  0      
 31 33  1  0      
 33 34  1  0      
 34 35  1  0      
 35 36  3  0      
 37 38  1  0      
 38 39  2  0      
 39 40  1  0      
 40 41  2  0      
 41 42  1  0      
 42 43  2  0      
 43 38  1  0      
 41 44  1  0      
 44 45  1  0      
 44 46  2  0      
 45 47  2  0      
 47 48  1  0      
 48 49  2  0      
 49 50  1  0      
 50 51  2  0      
 51 45  1  0      
 29 30  1  0      
 37 29  1  6      
M  END
$$$$
