B3608.sdf
  ChemDraw06161612332D

 41 45  0  0  0  0  0  0  0  0999 V2000
    1.1296    4.6825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5218   -0.2780    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4171    2.7284    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8410    4.2647    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5680   -4.6825    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3930   -4.6764    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2454   -1.9079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9928   -1.9253    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4000   -1.2078    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5279   -1.5007    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2454    0.9542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4309   -1.4977    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3028   -0.2048    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8226    1.7898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5401   -3.1506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5279    0.5470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8349    3.4397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9752   -3.9650    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2515   -2.7328    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3754   -0.6745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1780   -2.0543    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0929   -0.4421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8165    0.9648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2515    1.7792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5401    2.1970    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8165   -1.9185    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9691   -3.1400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9691    2.1864    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0990    0.5576    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6804    1.7686    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8226   -2.7434    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.5463    3.0220    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0929   -0.2674    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0990   -1.5113    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6804   -2.7222    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9752    3.0114    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3876    0.9754    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0099    3.4459    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3815    0.1504    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0593   -2.8444    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6496    0.1668    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  4  1  1  0      
  6  5  1  0      
  9  8  1  0      
 10  7  2  0      
 16  2  1  0      
 16 11  2  0      
 17  3  1  6      
 17  4  1  0      
 18  5  1  0      
 18  6  1  0      
 19  7  1  0      
 19 15  2  0      
 20 12  1  0      
 20 13  1  0      
 21  8  1  0      
 21 12  1  0      
 22  9  1  0      
 22 13  1  0      
 23 14  2  0      
 23 16  1  0      
 24 11  1  0      
 25 14  1  0      
 25 24  2  0      
 26 10  1  0      
 27 18  1  0      
 27 19  1  0      
 28 24  1  0      
 29 23  1  0      
 30 28  2  0      
 31 15  1  0      
 31 26  2  0      
 32 17  1  0      
 32 25  1  0      
 33 20  1  0      
 33 29  2  0      
 21 34  1  6      
 22 34  1  6      
 34 26  1  0      
 35 27  2  0      
 36 28  1  0      
 37 29  1  0      
 17 38  1  1      
 20 39  1  1      
 40 21  1  0      
 41 22  1  0      
M  END
$$$$
