TJLPAY0006
     RDKit          3D

 57 63  0  0  1  0  0  0  0  0999 V2000
   15.4818    3.3332   -1.5586 C   0  0  0  0  0  3  0  0  0  0  0  0
   16.1848    3.1865   -0.3697 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.2902    2.6323   -1.7355 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.9286    2.5895    1.1842 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.5539    1.5187    0.0401 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.9130    1.1955   -0.0708 C   0  0  0  0  0  3  0  0  0  0  0  0
   15.7121    2.3537    0.6362 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.7824    1.7753   -0.7527 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.4176   -0.0805   -0.4895 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8819    0.3633   -0.4424 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.7790    0.8505    1.1917 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.5164    1.6698    0.4398 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.0145   -0.4426   -0.5677 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5350    0.5935   -0.2288 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3021   -0.0899   -0.4329 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7070   -0.4376   -0.5284 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9965    0.3517   -0.1123 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2922    0.3602   -0.7860 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9531   -0.6962   -0.5825 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1102   -0.3131    0.5398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5468   -2.1267    0.2315 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4433   -2.8380    0.0686 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.5176   -1.7548   -0.7697 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.3065   -1.0339   -0.6893 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.9237    0.4135   -1.4428 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.1590   -1.7223   -0.7452 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.0038   -0.6039   -0.2977 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.9218   -3.2493   -0.0199 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.3855   -0.6845   -0.5047 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9585   -2.4462    0.1640 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.0007   -2.5483    0.2535 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2525   -2.9600   -1.0272 C   0  0  0  0  0  1  0  0  0  0  0  0
  -13.0971    0.7707   -0.6657 C   0  0  2  0  0  0  0  0  0  0  0  0
  -14.0339    1.7245   -1.3138 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.8667   -3.7492    3.3062 C   0  0  0  0  0  1  0  0  0  0  0  0
  -10.7219   -0.4095    0.8499 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3734   -2.3159    1.5742 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.7126    3.0491   -0.9140 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.2013   -1.2305    1.8624 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.5444    0.7306    1.3792 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.2347    2.4822    1.0198 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.2591    3.4960    0.4783 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.4329    3.9247   -0.1723 N   0  0  0  0  0  1  0  0  0  0  0  0
   13.2699   -0.8614   -0.0735 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4610    1.2411    0.7852 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2390    0.9571   -0.0436 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.5960    1.1627   -0.9711 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7704   -3.0052   -0.1253 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8473    0.0050   -1.6539 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2027   -3.6107   -0.0774 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.5231   -1.7069   -0.7540 N   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6430   -0.1407   -0.3901 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3353   -0.9054    0.7236 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.4263   -0.1401   -1.9002 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5681    1.3408    0.6423 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8437   -3.0939    2.5757 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.2828    1.1258    2.5192 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  2  7  1  0
  2 43  1  0
  3  8  2  0
  4 45  1  0
  5  6  2  0
  5 14  1  0
  6 15  1  0
  7 12  2  0
  8 12  1  0
  8 47  1  0
  9 13  1  0
  9 44  2  0
  9 47  1  0
 10 13  2  0
 10 16  1  0
 11 20  2  0
 11 45  1  0
 13 51  1  0
 14 19  2  0
 14 46  1  0
 15 16  1  0
 15 24  2  0
 16 26  2  0
 17 18  1  0
 17 27  2  0
 17 45  1  0
 18 46  1  0
 18 54  2  0
 19 24  1  0
 20 27  1  0
 20 53  1  0
 21 30  1  0
 21 48  2  0
 21 53  1  0
 22 28  1  0
 22 30  1  0
 23 29  2  0
 23 31  1  0
 25 33  1  0
 25 49  2  0
 26 51  1  0
 28 50  1  0
 29 36  1  0
 29 49  1  0
 31 37  2  0
 31 50  1  0
 32 51  1  0
 33 34  1  0
 33 52  1  1
 33 55  1  0
 34 38  1  0
 35 56  1  0
 36 39  2  0
 36 40  1  0
 37 39  1  0
 37 56  1  0
 38 42  1  0
 40 55  1  0
 40 57  2  0
 41 42  1  0
 41 55  1  0
M  RAD  8   1   2   3   2   4   2   5   2   6   2   7   2  10   2  11   2
M  RAD  8  12   2  19   2  22   3  23   2  24   2  25   2  26   2  27   2
M  RAD  8  28   3  30   3  32   2  34   3  35   2  38   3  39   2  41   3
M  RAD  5  42   3  43   3  46   2  47   2  53   2
M  END
$$$$
