A2588.cdx
  ChemDraw06111414242D

 31 32  0  0  0  0  0  0  0  0999 V2000
    3.9148    1.0160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4889    1.5950    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7743    1.5157    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4858    0.8572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9118    0.2781    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6263    0.3575    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7717    0.7779    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3459    1.3567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6342    2.0148    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6317    1.2773    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2059    1.8562    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3434    0.6192    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4240    2.5411    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1600    2.9603    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7391    2.5343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5129    1.8519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9319    1.2681    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6357    0.6134    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6469    1.3390    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0658    0.7552    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7809    0.8261    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0771    1.4808    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1998    0.2423    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9148    0.3132    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -1.7697    0.1005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1886   -0.4832    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8925   -1.1379    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3114   -1.7217    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0153   -2.3764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4342   -2.9603    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3002   -2.4473    0.0000 N   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      
  4  7  1  0      
  7  8  1  0      
  8  9  1  6      
  8 10  1  0      
 10 11  1  0      
 10 12  2  0      
 11 13  1  0      
 13 14  1  0      
 14 15  1  0      
 15 16  1  0      
 16 11  1  0      
 16 17  1  6      
 17 18  2  0      
 17 19  1  0      
 20 19  1  1      
 20 21  1  0      
 21 22  2  0      
 21 23  1  0      
 23 24  1  0      
 20 25  1  0      
 25 26  1  0      
 26 27  1  0      
 27 28  1  0      
 28 29  1  0      
 29 30  1  0      
 29 31  2  0      
M  END
$$$$
