B5698.sdf
  ChemDraw07171715492D

 57 58  0  0  0  0  0  0  0  0999 V2000
    1.3058    1.3755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8966    0.6592    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3124   -0.0534    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9032   -0.7698    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0782   -0.7736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3376   -0.0610    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3310   -1.4899    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1560   -1.4937    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5653   -2.2100    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1495   -2.9226    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3902   -2.2138    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7995   -2.9302    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6245   -2.9340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0402   -2.2214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0337   -3.6503    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0299   -4.4753    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3173   -4.0595    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8587   -3.6541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2679   -4.3705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9289   -5.1226    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5394   -5.6774    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2558   -5.2682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0880   -4.4605    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9745   -2.9264    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8060   -1.5013    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6310   -1.5050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7468   -0.7773    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0847   -2.2025    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9097   -2.1987    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3189   -1.4823    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3255   -2.9113    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7282   -0.7660    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1374   -0.0496    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5532   -0.7622    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5466    0.6667    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.3716    0.6705    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7808    1.3869    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3650    2.0994    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6058    1.3906    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0150    2.1070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8400    2.1108    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2492    2.8271    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2558    1.3982    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4308    1.3944    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5993    2.8196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0085    3.5359    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5927    4.2485    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0019    4.9649    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5861    5.6774    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9558    1.3831    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7874   -0.0421    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6124   -0.0383    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0942    0.6314    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8800    0.3800    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.8838   -0.4450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1003   -0.7035    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0716    0.6554    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  2  0      
  5  6  1  0      
  5  7  1  0      
  7  8  1  0      
  8  9  2  0      
  9 10  1  0      
  9 11  1  0      
 11 12  1  0      
 12 13  2  0      
 13 14  1  0      
 13 15  1  0      
 15 16  1  1      
 15 17  1  6      
 15 18  1  0      
 18 19  1  0      
 19 20  2  0      
 20 21  1  0      
 21 22  2  0      
 22 23  1  0      
 19 23  1  0      
 11 24  1  6      
 11 25  1  0      
 25 26  1  0      
  7 27  1  1      
  7 28  1  0      
 28 29  1  0      
 29 30  1  0      
 29 31  2  0      
  3 32  1  6      
  3 33  1  0      
 33 34  1  0      
 33 35  2  0      
 35 36  1  0      
 36 37  1  0      
 37 38  1  0      
 37 39  2  0      
 39 40  1  0      
 40 41  1  0      
 41 42  1  0      
 41 43  2  0      
 40 44  1  6      
 40 45  1  0      
 45 46  1  0      
 46 47  1  0      
 47 48  1  0      
 48 49  1  0      
 36 50  1  1      
 36 51  1  0      
 51 52  1  0      
 52 53  2  0      
 53 54  1  0      
 54 55  2  0      
 55 56  1  0      
 52 56  1  0      
  2 57  1  0      
M  END
$$$$
