
     RDKit          2D

 59 63  0  0  0  0  0  0  0  0999 V2000
    5.9684    8.2702    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2498    6.9535    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7502    6.9175    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9693    8.1982    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0316    5.6008    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5321    5.5648    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8135    4.2481    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6861    4.2121    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4047    2.8954    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6237    1.6148    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9042    2.8594    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6852    4.1401    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1848    4.1041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9034    2.7874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1224    1.5067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6228    1.5428    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4029    2.7514    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1839    4.0320    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1215    1.4347    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3406    0.1541    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0592   -1.1626    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2782   -2.4433    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7786   -2.4073    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9976   -3.6879    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4981   -3.6519    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7171   -4.9326    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7795   -2.3352    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5605   -1.0546    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8419    0.2621    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0600   -1.0906    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8410    0.1901    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5945    2.9675    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8759    1.6508    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0940    3.0035    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8750    1.7228    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3746    1.7589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1555    0.4782    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4370   -0.8385    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2179   -2.1191    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7175   -2.0831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4361   -0.7664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6551    0.5142    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1564    0.4062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6568    0.3702    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9374   -0.8745    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2188   -2.1912    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9998   -3.4718    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2812   -4.7885    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7816   -4.8245    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0630   -6.1412    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8440   -7.4218    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3436   -7.3858    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0622   -6.0691    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7192   -2.2272    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9383   -0.9465    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0006   -3.5438    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4989   -3.5799    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2175   -4.8965    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4366   -6.1772    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  7  6  1  1
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 14 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 25 27  1  0
 27 28  2  0
 28 29  1  0
 28 30  1  0
 30 31  2  0
  7 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  1
 36 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  2  0
 40 41  1  0
 41 42  2  0
 35 43  1  0
 43 44  2  0
 43 45  1  0
 45 46  1  0
 46 47  1  1
 47 48  1  0
 48 49  2  0
 49 50  1  0
 50 51  2  0
 51 52  1  0
 52 53  2  0
 46 54  1  0
 54 55  2  0
 54 56  1  0
 56 57  1  0
 57 58  1  0
 58 59  1  0
 16 11  1  0
 31 20  1  0
 42 37  1  0
 53 48  1  0
 30 23  1  0
M  END
$$$$
