
     RDKit          2D

 56 60  0  0  0  0  0  0  0  0999 V2000
  -10.6634    0.5239    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9912   -0.8170    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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   -7.6686    0.3474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8215   -2.2461    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5111   -3.5782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4574   -4.6457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1165   -3.9735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3415   -2.4904    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2740   -1.4367    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6528    0.0147    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8276   -1.8343    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4488   -3.2857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0025   -3.6834    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6237   -5.1347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1774   -5.5324    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8902   -4.4787    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5114   -3.0273    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9350   -2.6296    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7601   -0.7806    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1389    0.6708    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5852    1.0684    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0714    1.7245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4502    3.1759    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8965    3.5736    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2753    5.0249    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.6250    1.3269    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4425    2.3806    0.0000 P   0  0  0  0  0  0  0  0  0  0  0  0
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    1.4963    1.3131    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9476    1.6919    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0014    0.6243    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4844    0.8494    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1567   -0.4916    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.6367   -0.7358    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.1651   -2.1397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6451   -2.3840    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1735   -3.7878    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5966   -1.2244    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0766   -1.4687    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0682    0.1794    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.5882    0.4237    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0598    1.8275    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6112    3.4482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2136    4.8945    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2378    5.2733    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6355    6.7196    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5817    7.7872    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8697    7.4084    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2673    5.9620    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
 24 25  1  0
 25 26  1  0
 25 27  2  0
 23 28  1  0
 28 29  1  0
 29 30  2  0
 29 31  1  0
 31 32  1  0
 33 32  1  1
 33 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  1  6
 38 39  1  0
 39 40  3  0
 35 41  1  1
 41 42  1  0
 42 43  2  0
 43 44  1  0
 43 45  1  0
 45 46  2  0
 45 47  1  0
 47 48  1  0
 48 49  2  0
 29 50  1  0
 50 51  1  0
 51 52  2  0
 52 53  1  0
 53 54  2  0
 54 55  1  0
 55 56  2  0
  9  5  1  0
 19 14  1  0
 37 33  1  0
 48 41  1  0
 56 51  1  0
M  CHG  2  38  -1  39   1
M  END
$$$$
