TJLLIN0119
     RDKit          3D

 44 45  0  0  1  0  0  0  0  0999 V2000
   -1.4728   -3.5428   -3.2125 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.2235   -4.8346   -0.9083 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.6107    2.0978   -2.5205 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.2115    3.3583   -4.5587 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.0425    3.4873    1.8966 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.8235    1.8784    2.9452 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.3366   -3.3842   -1.6210 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.3065    2.4877   -3.8143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7282    1.2702   -1.7837 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.2380    1.4879    1.7326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5294   -0.4435   -1.9412 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9706   -1.2100    0.6744 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.9669   -1.9592    0.3805 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2555   -2.4568   -0.7691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0219   -2.1373   -0.9061 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.4498    0.8998   -2.2686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0555    2.1329   -4.3313 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.4943    2.1583    0.5772 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.2737    0.3319    1.7555 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1402    1.3799   -3.5529 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.4304   -0.6603    0.6604 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.4762   -1.6426    0.6102 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.4964   -2.2557   -0.0402 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1533   -1.1181   -0.6548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4755   -0.8037   -0.8329 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.7986   -0.7619    0.5822 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.1622   -0.8877    2.1110 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.5925   -1.0725    3.6293 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.5530   -0.4430    5.7396 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7350    2.8836    3.0654 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.4726    4.6323    1.9023 S   0  0  0  0  0  1  0  0  0  0  0  0
   -5.3313   -0.7908   -3.1182 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4076   -2.9272   -1.9032 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1055    4.2333   -5.2538 O   0  0  0  0  0  1  0  0  0  0  0  0
    9.7522    0.0074    0.5684 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3339   -1.4921   -1.2039 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.4252    3.1359    0.6852 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.1446   -1.9728   -0.1836 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.6023    0.2046   -1.4450 N   0  0  0  0  0  2  0  0  0  0  0  0
   10.1005   -0.2206    2.8506 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8760   -0.0183   -0.1549 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9208   -1.3927    5.0447 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.1358    0.9722    5.5658 N   0  0  0  0  0  1  0  0  0  0  0  0
   -7.3780   -0.6111    6.6386 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0
  2  7  1  0
  3  8  2  0
  3  9  1  0
  4  8  1  0
  4 34  1  0
  5 30  2  0
  5 31  1  0
  5 37  1  0
  6 10  2  0
  6 30  1  0
  8 17  1  0
  9 16  2  0
 10 18  1  0
 10 19  1  0
 11 25  1  0
 11 32  2  0
 11 39  1  0
 12 21  1  0
 12 22  1  0
 13 22  1  0
 13 23  1  0
 14 23  1  0
 14 33  2  0
 14 38  1  0
 15 24  1  0
 15 38  1  0
 15  7  1  0
 16 20  1  0
 16 39  1  0
 17 20  2  0
 18 37  2  0
 19 35  1  0
 19 40  2  0
 21 35  1  0
 24 36  1  0
 24 41  2  0
 25 26  1  0
 25 36  1  0
 26 27  1  0
 27 28  1  0
 28 42  1  0
 29 42  1  0
 29 43  1  0
 29 44  2  0
M  RAD  8   1   2   2   2   3   2   4   3   6   2   7   2   9   2  12   3
M  RAD  8  13   3  15   2  17   2  20   2  21   3  22   3  23   3  25   2
M  RAD  8  26   3  27   3  28   3  31   2  34   2  35   2  36   2  37   2
M  RAD  4  38   2  39   2  42   2  43   3
M  END
$$$$
