TJLLIN0012
     RDKit          3D

 41 42  0  0  1  0  0  0  0  0999 V2000
   -1.1594   -2.3303   -3.9427 C   0  0  0  0  0  1  0  0  0  0  0  0
    0.0495   -3.7516   -2.0906 C   0  0  0  0  0  1  0  0  0  0  0  0
   12.1142    2.0702    1.1570 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.6820    2.0789    1.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4962   -2.3058   -2.4963 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.7614    3.8827    1.7385 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.3767    5.2787    0.5071 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.8017    2.8553    1.7701 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.6068    1.2969    0.3970 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.3929    4.2199    0.5444 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1519   -1.0874   -2.7249 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7368    0.4687   -0.9377 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.9116   -0.3023   -1.8844 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.0432   -1.0811   -1.8491 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.5855    0.6553   -0.3908 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4908   -0.6993   -2.3255 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.8800    0.5502   -0.2698 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1428    0.8436   -0.4329 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.3263    0.0859   -1.4221 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.4169    2.1269    0.6323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0288   -0.3639   -0.9031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0398    3.5176   -0.6057 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.1188   -0.7334    0.1453 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.0751    2.4902   -0.5528 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.7841   -1.7360    0.9560 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4134   -2.9021    1.8091 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9678   -4.1203    2.6411 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4727   -5.1637    4.1984 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9692    2.7972    1.6929 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0651   -1.7934   -3.7239 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8954    0.9046   -1.4521 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9845   -1.1979   -0.4633 N   0  0  0  0  0  2  0  0  0  0  0  0
   -9.3367    6.3263    0.4816 O   0  0  0  0  0  1  0  0  0  0  0  0
   10.3746    1.1691    0.0259 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2297   -0.5606   -1.9256 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5075    1.1191    0.7879 N   0  0  0  0  0  2  0  0  0  0  0  0
   11.8554   -0.1719   -1.2442 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7816    0.7915   -0.5477 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4196   -5.3143    3.3942 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9460   -6.0323    4.9299 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1923   -3.8813    4.2625 N   0  0  0  0  0  1  0  0  0  0  0  0
  1  5  1  0
  2  5  1  0
  3  4  1  0
  3  9  2  0
  4 29  2  0
  4 34  1  0
  6  8  2  0
  6 10  1  0
  7 10  1  0
  7 33  1  0
  8 20  1  0
  9 15  1  0
 10 22  2  0
 11 16  1  0
 11 30  2  0
 11 35  1  0
 12 18  1  0
 12 19  1  0
 13 16  1  0
 13 19  1  0
 14 21  1  0
 14 35  1  0
 14  5  1  0
 15 34  1  0
 15 37  2  0
 17 31  2  0
 17 36  1  0
 18 34  1  0
 20 24  2  0
 20 36  1  0
 21 32  1  0
 21 38  2  0
 22 24  1  0
 23 25  1  0
 23 32  1  0
 23 17  1  0
 25 26  1  0
 26 27  1  0
 27 39  1  0
 28 39  1  0
 28 40  2  0
 28 41  1  0
M  RAD  8   1   2   2   2   3   2   5   2   6   2   7   3   8   2   9   2
M  RAD  8  12   3  13   3  14   2  16   3  18   3  19   3  22   2  23   2
M  RAD  8  24   2  25   3  26   3  27   3  32   2  33   2  35   2  36   2
M  RAD  2  39   2  41   3
M  END
$$$$
