
     RDKit          2D

 50 54  0  0  0  0  0  0  0  0999 V2000
  -11.1433   -4.2321    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.3599   -2.7478    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.7536   -2.1932    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.0577   -3.6621    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2529   -2.1488    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0411   -3.4250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.9641   -0.8281    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.1759    0.4482    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6766    0.4037    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9654   -0.9170    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4661   -0.9614    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6779    0.3148    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2021    0.5831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0152   -0.3342    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6274    0.2350    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4406   -0.6822    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0528   -0.1130    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8518    1.3735    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4640    1.9427    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2772    1.0254    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1106    1.5947    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2975    0.6774    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6853    1.2466    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8722    0.3294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6712   -1.1571    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2600    0.8986    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4468   -0.0187    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.8346    0.5506    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0356    2.0370    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.0215   -0.3667    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4093    0.2025    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   12.5961   -0.7147    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3952   -2.2012    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9839   -0.1455    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1708   -1.0627    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   16.5586   -0.4935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7595    0.9930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7455   -1.4108    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1333   -0.8416    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   19.7025   -2.2294    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.5640    0.5462    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   20.5211   -0.2723    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0387    2.2907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4265    1.7215    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6133    2.6388    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0011    2.0695    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3528    2.7200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3891    1.6355    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.8884    1.6800    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5996    3.0007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  6
  3  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  2  0
 24 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  2  0
 28 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  2  0
 36 38  1  0
 38 39  1  0
 39 40  1  0
 39 41  1  0
 39 42  1  0
 18 43  1  0
 43 44  2  0
 44 45  1  0
 45 46  2  0
 46 47  1  0
 47 48  1  0
 48 49  1  0
 49 50  2  0
 10  3  1  0
 48 12  1  0
 49  9  1  0
 46 13  1  0
 44 15  1  0
M  END
$$$$
