A8141.cdx
  ChemDraw06191308582D

 50 55  0  0  0  0  0  0  0  0999 V2000
   -1.9624    2.5504    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1598    1.8341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6575    1.2995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9579    1.4812    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7605    2.1975    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2627    2.7321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0608    2.3791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4647    3.0850    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1643    2.9033    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6666    3.4379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4415    1.8445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1412    2.0262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5428    4.1716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1805    4.5198    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6985    4.0014    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3808    3.3327    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6948    1.5487    0.0000 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.3058    1.9447    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1298    2.6669    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4100    2.7173    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7161    2.9210    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4211    3.4619    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6460    0.8058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1725    4.8107    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8214    4.1601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7182    2.6745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3566    5.2420    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0505    5.4458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5684    4.9273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3924    4.2051    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9998    1.7409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5177    2.2594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3417    2.9816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6478    3.1853    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2450    0.3906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1962   -0.3524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7951   -0.7675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7463   -1.5105    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3453   -1.9256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2965   -2.6686    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8954   -3.0837    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8466   -3.8267    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4456   -4.2419    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9931   -1.5978    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4723   -4.9860    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1662   -5.1898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5684   -4.5716    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1230   -3.9857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3205   -3.2694    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9047   -5.4458    0.0000 O   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  2  0      
  6  1  1  0      
  5  7  1  0      
  1  8  2  0      
  8  9  1  0      
  9 10  2  0      
  7 11  2  0      
 11 12  1  0      
 10 13  1  0      
 13 14  1  0      
 14 15  1  0      
 15 16  1  0      
 16 10  1  0      
 12 17  2  0      
 17 18  1  0      
 18 19  1  0      
 19 20  1  0      
 20 12  1  0      
 20 21  1  0      
 20 22  1  0      
 17 23  1  0      
 13 24  1  0      
 13 25  1  0      
 16 26  1  0      
 14 27  2  0      
 27 28  1  0      
 28 29  2  0      
 29 30  1  0      
 30 15  2  0      
 18 31  2  0      
 31 32  1  0      
 32 33  2  0      
 33 34  1  0      
 34 19  2  0      
 23 35  1  0      
 35 36  1  0      
 36 37  1  0      
 37 38  1  0      
 38 39  1  0      
 39 40  1  0      
 40 41  1  0      
 41 42  1  0      
 42 43  1  0      
 39 44  2  0      
 43 45  1  0      
 45 46  1  0      
 46 47  2  0      
 47 48  1  0      
 48 43  1  0      
 48 49  2  0      
 45 50  2  0      
M  CHG  1  17   1
M  END
$$$$
