C8749.sdf
  ChemDraw02112613122D

 44 48  0  0  1  0  0  0  0  0999 V2000
   -3.7295   -1.7122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0207   -2.1344    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9457   -2.9560    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5663   -3.4996    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3709   -3.3170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7931   -4.0258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2495   -4.6464    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4913   -4.3212    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6180   -4.0145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0403   -4.7232    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0207   -3.2944    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5985   -2.5857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7735   -2.5970    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1412   -3.1386    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7189   -2.4298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8973   -2.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5515   -1.6059    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2701   -1.5309    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    0.6159   -0.7819    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4375   -0.7069    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.7834    0.0421    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6050    0.1171    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9508    0.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7601    1.0266    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8575    1.8458    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1085    2.1917    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9481    3.0009    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5481    1.5862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7289    1.6837    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5776    2.2485    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5889    3.0734    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3089    3.4761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3202    4.3010    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0403    4.7037    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.6115    4.7232    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.0177    3.0538    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0064    2.2289    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2863    1.8262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9133   -1.3809    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9618   -0.0329    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7458   -2.2049    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2056   -0.8568    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2625   -1.8092    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0799   -1.0047    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6      
  2  3  1  0      
  3  4  1  1      
  4  5  1  0      
  5  6  1  0      
  6  7  1  0      
  7  8  2  0      
  4  8  1  0      
  6  9  2  0      
  9 10  1  0      
  9 11  1  0      
 11 12  2  0      
 12 13  1  0      
  5 13  2  0      
  3 14  1  0      
 14 15  1  0      
 15 16  1  1      
 16 17  1  0      
 17 18  1  0      
 18 19  1  0      
 19 20  1  0      
 20 21  1  0      
 21 22  1  0      
 23 22  1  6      
 23 24  1  0      
 24 25  1  0      
 25 26  1  0      
 26 27  1  1      
 26 28  1  0      
 23 28  1  0      
 28 29  1  1      
 25 30  1  6      
 30 31  1  0      
 31 32  2  0      
 32 33  1  0      
 33 34  1  0      
 33 35  2  0      
 32 36  1  0      
 36 37  1  0      
 37 38  2  0      
 30 38  1  0      
 20 39  2  0      
 20 40  1  0      
 18 41  2  0      
 18 42  1  0      
 15 43  1  0      
  2 43  1  0      
 43 44  1  6      
M  END
$$$$
