
     RDKit          2D

 48 52  0  0  0  0  0  0  0  0999 V2000
   -7.4789    4.2951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6435    2.8041    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4346    1.9162    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0611    2.5191    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5991    0.4252    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9020   -0.3180    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5978   -1.7868    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1069   -1.9514    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4896   -0.5843    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0208   -0.2801    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5499    1.1441    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0229   -1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4939   -2.8241    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4960   -3.9441    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9669   -5.3682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9691   -6.4881    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5002   -6.1839    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0293   -4.7598    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0272   -3.6398    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5541   -1.0958    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0832    0.3284    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
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    0.3410   -0.1425    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4609    0.8553    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8851    0.3844    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1032    1.2597    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3121    0.3718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8411   -1.0524    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3412   -1.0446    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4532   -2.2535    0.0000 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.0561   -3.6270    0.0000 N   0  0  0  0  0  4  0  0  0  0  0  0
    3.6591   -5.0005    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7411    0.8278    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8505   -0.1816    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2795    0.2745    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3890   -0.7350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5990    1.7400    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0280    2.1961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4895    2.7495    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0606    2.2934    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9511    3.3029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5073    0.7993    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8115    2.2682    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6916    3.2660    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9958    4.7349    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4200    5.2058    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5399    4.2079    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2357    2.7391    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  0
 25 24  1  1
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  6
 30 31  1  0
 31 32  3  0
 27 33  1  1
 33 34  1  0
 34 35  2  0
 35 36  1  0
 35 37  1  0
 37 38  2  0
 37 39  1  0
 39 40  1  0
 40 41  2  0
 21 42  1  0
 42 43  1  0
 43 44  2  0
 44 45  1  0
 45 46  2  0
 46 47  1  0
 47 48  2  0
  9  5  1  0
 19 14  1  0
 29 25  1  0
 40 33  1  0
 48 43  1  0
M  CHG  2  30  -1  31   1
M  END
$$$$
