
     RDKit          2D

 53 57  0  0  0  0  0  0  0  0999 V2000
  -10.8699    1.1998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2556   -0.1687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7633   -0.3209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8854    0.8953    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1490   -1.6893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8951   -2.9907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8879   -4.1023    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5195   -3.4880    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6809   -1.9967    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5692   -0.9896    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8856    0.4767    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1412   -1.4487    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8249   -2.9150    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3969   -3.3741    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0805   -4.8404    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6525   -5.2995    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4591   -4.2924    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1428   -2.8262    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2852   -2.3670    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0296   -0.4416    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3460    1.0246    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7740    1.4838    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2343    2.0317    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5507    3.4980    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8063    1.5726    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.3053    2.5797    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
    1.4169    3.5868    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3124    1.4681    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7787    1.7844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7858    0.6728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2771    0.8342    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8914   -0.5343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7797   -1.5414    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4784   -0.7954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1100   -1.4097    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.9577   -2.9019    0.0000 N   0  0  0  0  0  4  0  0  0  0  0  0
    1.8055   -4.3942    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.3595   -0.8416    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8274   -2.2668    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2956   -2.5742    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7635   -3.9993    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2959   -1.4564    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7641   -1.7637    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8280   -0.0312    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.3598    0.2761    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8919    1.7013    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7018    3.6913    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2427    5.1193    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2236    5.4357    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6827    6.8637    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6756    7.9753    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7906    7.6590    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2498    6.2310    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  2  0
  5  3  1  1
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  1  1
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 12 20  1  0
 20 21  1  0
 21 22  2  0
 21 23  1  0
 23 24  1  6
 23 25  1  0
 25 26  1  0
 26 27  2  0
 26 28  1  0
 28 29  1  0
 30 29  1  1
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  6
 35 36  1  0
 36 37  3  0
 32 38  1  1
 38 39  1  0
 39 40  2  0
 40 41  1  0
 40 42  1  0
 42 43  2  0
 42 44  1  0
 44 45  1  0
 45 46  2  0
 26 47  1  0
 47 48  1  0
 48 49  2  0
 49 50  1  0
 50 51  2  0
 51 52  1  0
 52 53  2  0
  9  5  1  0
 19 14  1  0
 34 30  1  0
 45 38  1  0
 53 48  1  0
M  CHG  2  35  -1  36   1
M  END
$$$$
