B1064.sdf
  ChemDraw11122016262D

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    0.8484    1.4574    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5176   -2.2284    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1867   -0.9658    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7887    2.2284    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1867    1.3521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5111   -1.4755    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7588   -1.0177    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7289   -0.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000    0.1931    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2314   -1.0617    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4877   -1.4040    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0299    1.0175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6991   -0.2450    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7589    1.4039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4280    0.1414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4579    0.9658    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  2 11  2  0      
  3 11  1  0      
  4 14  1  0      
  5 16  1  0      
  7  6  1  0      
  7  8  1  0      
  7 10  1  1      
  7 11  1  0      
  8  9  1  0      
  9 12  2  0      
  9 13  1  0      
 12 14  1  0      
 15 13  2  0      
 14 16  2  0      
 16 15  1  0      
A    1
1.5H\s2\nO
V    2 1
V    3 2
V    4 3
V    5 4
V    6 5
V    7 6
V    8 7
V    9 8
V   10 9
V   11 10
V   12 11
V   13 12
V   14 13
V   15 14
V   16 15
M  END
$$$$
