C4397.sdf
  ChemDraw08281713262D

 46 48  0  0  0  0  0  0  0  0999 V2000
   -3.5559   -2.1332    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8021   -2.4683    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6301   -3.2752    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1817   -3.8886    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0097   -4.6954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7240   -5.1084    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3374   -4.5567    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0023   -3.8028    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4876   -3.1357    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3080   -3.2224    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6431   -3.9763    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1578   -4.6434    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4929   -5.3973    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8095   -3.3609    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4744   -2.6070    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6675   -2.4350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4131   -1.6503    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3938   -1.4782    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    0.6483   -0.6935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4551   -0.5215    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.7096    0.2633    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5165    0.4353    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7710    1.2201    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2856    1.8872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4606    1.8867    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7702    2.5550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5148    3.3394    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5549    2.3005    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2221    2.7858    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1354    3.6062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8025    4.0915    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7158    4.9120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3830    5.3973    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.9619    5.2471    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5564    3.7564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6431    2.9360    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9760    2.4507    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5554    1.4755    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9027    0.0913    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.0075   -1.1342    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1586   -0.8655    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9462   -2.0910    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0878   -2.0554    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0021   -1.2348    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1572    0.8761    0.0000 Na  0  3  0  0  0  0  0  0  0  0  0  0
   -0.9655   -1.0375    0.0000 Na  0  3  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  2  0      
  6  7  1  0      
  7  8  2  0      
  4  8  1  0      
  8  9  1  0      
  9 10  2  0      
 10 11  1  0      
 11 12  2  0      
  7 12  1  0      
 12 13  1  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  1      
 24 26  1  0      
 26 27  1  1      
 26 28  1  0      
 28 29  1  6      
 29 30  1  0      
 30 31  2  0      
 31 32  1  0      
 32 33  1  0      
 32 34  2  0      
 31 35  1  0      
 35 36  1  0      
 36 37  2  0      
 29 37  1  0      
 28 38  1  0      
 23 38  1  0      
 20 39  1  0      
 20 40  2  0      
 18 41  1  0      
 18 42  2  0      
 15 43  1  0      
  2 43  1  0      
 43 44  1  6      
M  CHG  4  39  -1  41  -1  45   1  46   1
M  END
$$$$
