TJLLIN0120
     RDKit          3D

 47 49  0  0  1  0  0  0  0  0999 V2000
   -3.1488   -2.8547    2.9353 C   0  0  0  0  0  1  0  0  0  0  0  0
   -2.3444   -0.5784    3.9972 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.6700   -2.7649   -2.2346 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.7656   -2.6669   -3.5619 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.6952    0.0969   -1.6644 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2912    0.1965   -2.0144 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.6985   -1.3551    2.6467 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.6737   -2.0243   -2.8597 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6228   -2.1204   -1.5415 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.0602   -0.2947   -0.7317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5202   -0.5833   -0.1568 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8107   -0.5363   -0.1907 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7787   -0.8420    0.5119 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.0357   -1.4075    1.4553 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3358   -0.8571    1.3238 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.5284   -0.7229   -1.4413 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6046   -0.6369   -2.7852 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.1463   -0.5918    0.1056 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.6727   -0.5181   -0.2107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5538   -0.0124   -2.0918 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.3158   -0.3757   -0.5889 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2921   -0.6739    0.1581 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2902   -1.0758    0.9326 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4802   -0.2610    0.4642 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7295    0.4495    0.7084 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.4384    1.5292    1.3776 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.1521    2.7172    2.1320 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8426    3.8969    2.9278 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.6056    6.1684    3.1589 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5917    0.3971   -2.4896 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.1864   -1.7735   -0.1730 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0435   -2.1993    2.3929 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.8461   -3.2834   -4.2513 O   0  0  0  0  0  1  0  0  0  0  0  0
    8.7001   -0.1753   -1.0649 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4819    0.2184    1.2264 N   0  0  0  0  0  2  0  0  0  0  0  0
   13.4495   -0.3906   -0.3826 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0471   -0.8200    0.8070 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5799   -0.0074   -0.7742 N   0  0  0  0  0  2  0  0  0  0  0  0
    9.5774   -0.9835    0.9248 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3244   -0.1492   -0.7550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4870    4.9687    3.7319 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.1758    6.3850    1.7658 N   0  0  0  0  0  1  0  0  0  0  0  0
   -9.0684    7.1766    3.6939 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0384    0.2379   -2.0009 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.8077   -0.1359   -1.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.9542   -0.6699    0.4031 S   0  0  0  0  0  0  0  0  0  0  0  0
   17.5193   -0.0962   -1.0825 S   0  0  0  0  0  1  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 33  1  0
  5 30  2  0
  5 36  1  0
  5 44  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 31  2  0
 11 38  1  0
 12 21  1  0
 12 22  1  0
 13 22  1  0
 13 23  1  0
 14 23  1  0
 14 32  2  0
 14 37  1  0
 15 24  1  0
 15 37  1  0
 15  7  1  0
 16 20  1  0
 16 38  1  0
 17 20  2  0
 18 36  2  0
 19 34  1  0
 19 39  2  0
 21 34  1  0
 24 35  1  0
 24 40  2  0
 25 26  1  0
 25 35  1  0
 26 27  1  0
 27 28  1  0
 28 41  1  0
 29 41  1  0
 29 42  1  0
 29 43  2  0
 44 45  2  0
 45 46  1  0
 45 47  1  0
 46 36  1  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  18   2  20   2  21   3  22   3  23   3
M  RAD  8  25   2  26   3  27   3  28   3  30   2  33   2  34   2  35   2
M  RAD  5  37   2  38   2  41   2  42   3  47   2
M  END
$$$$
