A3123.sdf
  ChemDraw02192011282D

 29 33  0  0  1  0  0  0  0  0999 V2000
   -1.8517    1.2034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8517    0.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1373   -0.0341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4228    0.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4228    1.2034    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1373    1.6159    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1903    1.7554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1453    2.5091    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9657    2.4229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0153    1.7554    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5662    1.6159    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2917   -0.0341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5662   -0.0341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5662   -0.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8517   -1.2716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1373   -0.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1496   -1.4425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7750   -2.1775    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9602   -2.0485    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2917   -0.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0062   -1.2716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7206   -0.8591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7206   -0.0341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0062    0.3784    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0062   -2.0966    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7206   -2.5091    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4351   -1.2716    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4351    0.3784    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1496   -0.0341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0      
  2  3  1  0      
  3  4  1  0      
  4  5  1  0      
  5  6  1  0      
  6  1  1  0      
  7  8  1  0      
  8  9  1  0      
  9  6  1  0      
  5  7  1  6      
  7 10  2  0      
  1 11  1  1      
  4 12  1  1      
  2 13  2  0      
 13 14  1  0      
 14 15  2  0      
 15 16  1  0      
 16  3  2  0      
 14 17  1  0      
 17 18  1  0      
 18 19  1  0      
 19 15  1  0      
 12 20  1  0      
 20 21  2  0      
 21 22  1  0      
 22 23  2  0      
 23 24  1  0      
 24 12  2  0      
 21 25  1  0      
 25 26  1  0      
 22 27  1  0      
 23 28  1  0      
 28 29  1  0      
V    1 9
V    2 9a
V    3 4a
V    4 5
V    5 5a
V    6 8a
V    7 6
V    8 7
V    9 8
V   12 1
V   13 10
V   14 10a
V   15 3a
V   16 4
V   17 1
V   18 2
V   19 3
V   20 2
V   21 3
V   22 4
V   23 5
V   24 6
M  END
$$$$
