TJLLIN0013
     RDKit          3D

 42 43  0  0  1  0  0  0  0  0999 V2000
   -1.1486    4.2442   -3.6338 C   0  0  0  0  0  1  0  0  0  0  0  0
    0.3405    4.8657   -1.6001 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.4189    3.6611   -2.3366 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.2943    3.1824    2.0562 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.6812    2.8498    2.5918 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.0571    2.6849    1.5986 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.3918    2.3343    2.1953 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0683    0.9750   -2.3826 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6003   -1.9414    0.0319 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.3169   -0.6710   -0.7829 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.4297   -0.3733    0.4399 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0990    2.2976   -2.3103 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.1527   -2.3898    0.2616 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5713    1.5036    0.6466 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1489   -1.7935   -0.1359 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.8587    1.3415    1.2493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9109    1.1988   -1.9857 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2269    0.9890    1.8722 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.7614   -0.2629   -0.0962 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.5236    0.8132   -0.2827 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.9871    0.5155    1.4072 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.8466   -2.0306   -0.9451 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9964   -1.1689   -0.8344 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.2169   -0.5867   -0.1055 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9237   -2.1083    0.1873 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6759   -3.6219    0.5554 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8105   -5.3411    1.9909 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1046    0.6182   -2.9557 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0399    0.3638    1.3241 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2704    2.5546    1.2299 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8120    1.6480   -1.0976 N   0  0  0  0  0  2  0  0  0  0  0  0
  -10.9459    3.3801    2.9586 O   0  0  0  0  0  1  0  0  0  0  0  0
    3.8827   -2.7244    0.4675 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5865    0.3276   -1.2742 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.8546   -1.4721   -0.1654 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4043    2.0946   -2.6961 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.7173    0.7950    0.7345 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8832    0.1416   -2.6161 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8808   -3.0664   -1.5878 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5274   -5.0604    0.8987 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8797   -6.3724    2.6575 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2190   -4.3950    2.4694 N   0  0  0  0  0  1  0  0  0  0  0  0
  1  3  1  0
  2  3  1  0
  4  6  2  0
  4  7  1  0
  5  7  1  0
  5 32  1  0
  6 16  1  0
  7 18  2  0
  8 28  2  0
  8 34  1  0
  8 36  1  0
  9 13  1  0
  9 35  1  0
 10 15  1  0
 10 34  1  0
 11 19  1  0
 11 29  2  0
 11 35  1  0
 12  3  1  0
 12 17  1  0
 12 36  1  0
 13 33  1  0
 14 20  1  0
 14 30  2  0
 14 37  1  0
 15 33  1  0
 16 21  2  0
 16 37  1  0
 17 31  1  0
 17 38  2  0
 18 21  1  0
 19 23  2  0
 20 24  1  0
 20 31  1  0
 22 23  1  0
 22 35  1  0
 22 39  2  0
 24 25  1  0
 25 26  1  0
 26 40  1  0
 27 40  1  0
 27 41  2  0
 27 42  1  0
M  RAD  8   1   2   2   2   3   2   4   2   5   3   6   2   9   3  10   3
M  RAD  8  12   2  13   3  15   3  18   2  19   2  20   2  21   2  23   2
M  RAD  8  24   3  25   3  26   3  31   2  32   2  36   2  37   2  40   2
M  RAD  1  42   3
M  END
$$$$
