TJL0206
     RDKit          3D

104113  0  0  1  0  0  0  0  0999 V2000
   20.1621    0.1477    0.4841 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.6963   -0.9032    1.7742 C   0  0  0  0  0  2  0  0  0  0  0  0
   18.7764    0.7855   -0.2048 C   0  0  2  0  0  0  0  0  0  0  0  0
   17.3897   -0.7394    1.2602 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4265    0.1674    0.2342 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1591   -1.5072    1.6329 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.1681    0.3753   -0.3637 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.2302   -1.3410   -1.5111 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.1430   -1.3173   -0.1757 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.2859   -0.3563   -2.3668 C   0  0  0  0  0  3  0  0  0  0  0  0
   15.0218   -0.2052   -0.1169 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8586   -1.8948    0.6765 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.9402   -0.3298    0.3455 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1204    0.6436   -1.8530 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.7676   -0.2861   -0.8858 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1686   -0.3903    1.7643 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.3929    0.6620   -0.4764 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.0574   -1.3562   -0.3524 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.3036   -2.5041   -1.0580 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.4032   -0.9116   -2.7786 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2383    1.8964   -3.2250 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.4376   -1.5777   -0.5801 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8397    3.8715    0.1934 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9796    2.6946    2.1701 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.4887   -0.5708    3.1563 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.9510    0.0269    0.8122 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.8508   -1.0242    1.1297 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.8834   -1.7685   -0.9359 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.1742    0.1762   -2.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7637   -0.8929    3.9815 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7858   -1.0022    1.0887 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6208    3.2194   -3.0545 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1870   -2.0294   -2.0122 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.7725    0.4546   -3.1473 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.0725    3.3398   -0.7245 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.4433    1.4948    2.8901 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9318   -0.3220    3.6731 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5675   -2.1891    1.6354 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.1124   -2.9847   -0.4706 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.5008    0.4086    3.9393 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.7982   -0.9594    2.1873 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.4166   -0.9835   -2.0529 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.7071    0.9781   -3.4197 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.4222   -1.6251    0.4570 C   0  0  0  0  0  2  0  0  0  0  0  0
  -11.6124   -2.9740    1.0044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3669    2.8629   -0.2574 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.1653   -3.4870   -1.4353 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.2587   -1.3220   -2.8425 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.5389    0.6750   -4.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9082   -2.3698    1.5385 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.6811   -2.5988   -2.5515 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.8118   -0.4965   -3.8652 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6815   -0.9413   -4.8941 C   0  0  0  0  0  1  0  0  0  0  0  0
   21.3260    0.2973    0.0755 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.9700   -0.6123    1.6346 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.9304    0.6227   -1.5171 O   0  0  0  0  0  1  0  0  0  0  0  0
   16.2249   -2.3743    2.5138 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0315   -1.2303    0.8536 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9486    4.5293   -0.3927 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4665   -1.9022    4.0072 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8773   -2.0733    0.4864 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.3631    0.5143   -1.8894 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6359   -1.1990   -1.7464 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7059    3.2404   -2.0812 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.4931    1.6195    3.8235 N   0  0  0  0  0  2  0  0  0  0  0  0
   10.8327   -3.2232    0.8201 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.8994   -1.2360    3.3747 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.3589   -2.3401   -0.2146 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9174    3.7422    1.5280 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.5399   -0.9722    4.0822 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.4327    0.1366    0.8232 N   0  0  0  0  0  2  0  0  0  0  0  0
    9.3027    0.1368    0.7505 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8161    4.1548   -3.8537 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9501    0.4596    4.6648 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0300    0.4545    2.6320 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9570   -2.1650    2.8089 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.1883    1.5121   -5.0575 F   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1022   -4.0228    1.4801 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8423   -3.3790    2.3569 C   0  0  0  0  0  1  0  0  0  0  0  0
   18.7594    2.2664    0.0866 C   0  0  0  0  0  2  0  0  0  0  0  0
   18.7437    3.7609    0.5243 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.7318    1.9929    0.2549 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.3307    0.7448    0.7388 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6254    1.4668    1.3935 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.4515    1.7577    2.6777 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.0015    1.5198    0.8672 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.8708    1.9513    2.2779 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.2820    1.5996   -0.1258 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.0116    0.3353   -1.3569 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.9081   -0.8674   -1.6141 C   0  0  0  0  0  3  0  0  0  0  0  0
  -18.8479    1.1293   -2.6108 C   0  0  0  0  0  3  0  0  0  0  0  0
  -19.4847    1.9934   -3.6099 C   0  0  0  0  0  2  0  0  0  0  0  0
  -19.1115   -0.3117   -2.3441 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.5107    0.6471    1.4021 N   0  0  0  0  0  2  0  0  0  0  0  0
   -8.7394   -0.2627    0.3316 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1858    1.2490    3.8043 O   0  0  0  0  0  1  0  0  0  0  0  0
  -12.6383    1.3266    0.3307 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.8938    0.3933   -0.4885 N   0  0  0  0  0  2  0  0  0  0  0  0
  -14.5127    2.9223    2.7549 O   0  0  0  0  0  1  0  0  0  0  0  0
  -17.6211    1.4848   -1.9227 O   0  0  0  0  0  0  0  0  0  0  0  0
  -15.6651    2.7263   -0.5230 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.3766   -1.9153   -2.1575 O   0  0  0  0  0  1  0  0  0  0  0  0
  -20.1656    2.9040   -4.4895 O   0  0  0  0  0  1  0  0  0  0  0  0
  -20.2826   -0.7358   -2.0749 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  3  1  0
  1 54  2  0
  1 55  1  0
  2  4  1  0
  2 55  1  0
  3  5  1  0
  3 56  1  6
  3 80  1  0
  4  5  2  0
  4  6  1  0
  5  7  1  0
  6 57  2  0
  6 58  1  0
  7 11  2  0
  8  9  2  0
  8 10  1  0
  9 13  1  0
 10 14  2  0
 11 15  1  0
 11 58  1  0
 12 18  1  0
 12 58  1  0
 13 16  1  0
 13 17  2  0
 14 17  1  0
 15 18  2  0
 15 62  1  0
 18 28  1  0
 19 33  1  0
 19 68  1  0
 20 33  1  0
 20 34  1  0
 21 32  1  0
 21 34  1  0
 22 44  1  0
 22 63  2  0
 22 68  1  0
 23 35  1  0
 23 59  2  0
 23 69  1  0
 24 36  1  0
 24 69  1  0
 25 16  1  0
 25 37  1  0
 25 70  1  0
 26 71  1  0
 26 72  1  0
 27 38  1  0
 27 72  1  0
 28 39  1  0
 28 42  2  0
 29 42  1  0
 29 43  1  0
 29 62  2  0
 30 40  1  0
 30 60  2  0
 30 70  1  0
 31 41  1  0
 31 61  2  0
 31 71  1  0
 32 64  1  0
 32 73  2  0
 35 64  1  0
 35 46  1  0
 36 65  1  0
 36 75  2  0
 37 67  1  0
 37 74  2  0
 38 66  1  0
 38 76  2  0
 39 47  1  0
 39 66  1  0
 40 65  1  0
 41 67  1  0
 42 48  1  0
 43 49  2  0
 44 50  1  0
 45 50  1  0
 45 68  1  0
 45 78  2  0
 46 82  1  0
 47 51  1  0
 48 51  1  0
 48 52  2  0
 49 52  1  0
 49 77  1  0
 50 79  1  0
 52 53  1  0
 80 81  1  0
 82 83  1  0
 83 94  1  0
 83 95  2  0
 84 85  1  0
 84 94  1  0
 84 97  1  0
 85 87  1  0
 85 96  1  0
 86 87  1  0
 86 88  1  0
 86 97  1  0
 87 99  1  0
 88 98  1  0
 88101  2  0
 89 90  1  0
 89 98  1  0
 89100  1  0
 90 93  1  0
 90102  1  0
 91 92  1  0
 91 93  1  0
 91100  1  0
 92103  1  0
 93104  1  0
M  RAD  8   2   3   7   2   8   2   9   2  10   2  12   3  14   2  16   3
M  RAD  8  17   2  19   3  20   3  21   3  24   3  25   2  26   3  27   3
M  RAD  8  33   3  34   3  35   2  39   2  40   3  41   3  43   2  44   3
M  RAD  8  46   3  47   3  50   2  51   3  53   2  56   2  64   2  65   2
M  RAD  8  66   2  67   2  69   2  70   2  71   2  79   2  80   3  81   2
M  RAD  8  82   3  84   2  85   2  86   2  87   2  89   2  90   2  91   2
M  RAD  8  92   3  93   2  94   2  96   2  98   2  99   2 102   2 103   2
M  RAD  1 104   2
M  END
$$$$
