
     RDKit          2D

 42 44  0  0  0  0  0  0  0  0999 V2000
    7.8316   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3316   -1.2990    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8042   -2.5417    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5816    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0816    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8060    1.4745    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0164    2.7498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8193    3.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3766    4.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1170    3.9258    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4597    3.2572    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4703    2.1487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3178    3.0193    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0121    0.7500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4866    1.0256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9851    2.4404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0092    3.5795    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5077    4.9942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9822    5.2698    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9581    4.1307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4596    2.7160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0121   -0.7500    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4866   -1.0256    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4703   -2.1487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7456   -2.9384    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4597   -3.2572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3637   -4.4542    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1170   -3.9258    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3766   -4.0642    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1926   -5.2652    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8193   -3.6537    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4880   -4.9965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6594   -6.2469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1623   -6.1545    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6663   -7.4049    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0023   -8.7477    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8262   -9.9981    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4995   -8.8400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3280   -7.5896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0164   -2.7498    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8060   -1.4745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9960   -2.1119    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  5  4  1  1
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  1
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 14 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  2  0
 24 26  1  0
 26 27  1  1
 26 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  1
 32 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 36 38  1  0
 38 39  2  0
 31 40  1  0
 40 41  1  0
 41 42  2  0
 41  5  1  0
 21 16  1  0
 39 33  1  0
M  END
