TJL0265
     RDKit          3D

100108  0  0  1  0  0  0  0  0999 V2000
   -0.0839    5.6351   -2.2460 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.6507    4.4834   -2.2395 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.7668    6.0681   -1.1217 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.6110    3.6755   -1.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6639    5.3387    0.0669 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.9840   -0.1823    5.7874 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.8559    2.2780   -1.2413 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0141    4.1426    0.0698 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.8292   -0.3977    4.3415 C   0  0  0  0  0  0  0  0  0  0  0  0
   14.3203   -0.2686    4.5411 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.2006    0.0507    5.3539 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0025    0.8540   -1.2154 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.2090   -3.8012   -1.7024 C   0  0  0  0  0  2  0  0  0  0  0  0
  -11.2209    0.9642   -5.1506 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.4514    3.7801   -5.6374 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.9106    4.7425   -3.0491 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9046    3.3625    0.6795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4931    2.6046    0.2531 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7119    0.5161    0.5289 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3431   -2.8916   -3.8017 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5758   -3.7781    0.0023 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.2999   -2.2876    1.2654 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.1747   -0.2244   -4.2908 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3139    3.7810   -2.1116 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2567    1.7724    0.3462 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3991    0.2613   -1.6187 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9743   -3.7143    0.5081 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.7762    2.2952   -5.7957 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.2499    4.8182   -4.5273 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.3103    2.9905    0.0656 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.7811    1.5137    0.2302 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.9392   -1.5985   -3.1741 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.1716   -0.5325    2.4254 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.2149   -0.2412    3.5320 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.7301   -0.1665    3.8116 C   0  0  1  0  0  0  0  0  0  0  0  0
   17.9054    2.2072    2.2490 C   0  0  0  0  0  1  0  0  0  0  0  0
   13.3045   -0.2650    1.9376 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.3001    1.0014    3.0556 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.1799   -4.9162    1.6566 C   0  0  0  0  0  1  0  0  0  0  0  0
    8.0586   -4.1970   -0.6276 C   0  0  0  0  0  1  0  0  0  0  0  0
   14.5598   -0.2253    2.2564 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.3386   -0.2898   -3.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8715   -0.9772    0.2285 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.2144   -0.4456    1.0087 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2497    2.1254    0.8595 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.5442   -0.2331   -2.0608 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.2134    0.9136    1.3725 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.9567   -0.6939   -0.8331 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.5397   -0.2128    0.6948 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2818   -0.5281   -0.0029 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.9127   -0.3836    1.6956 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4431   -0.1819   -2.1591 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.7067   -0.1357   -1.3123 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8217    0.0172   -2.4633 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.0863    0.0997   -1.5067 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.2070   -2.3991    3.8469 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.9975   -1.4171    2.6445 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.3048    0.3255   -3.7336 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.5465    0.3536   -2.7968 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.0660   -2.4699    2.8561 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.6832    0.4984   -3.8765 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.4313   -3.2955    3.6558 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.4336    0.5346   -5.0012 C   0  0  0  0  0  1  0  0  0  0  0  0
  -17.3373   -4.4262    2.6397 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.9921   -4.6464    1.9372 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.5913   -5.8615    1.1878 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.1087   -0.4371    5.3477 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8926    3.9267    1.7764 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8738   -0.0094    1.6497 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0252   -3.0336   -4.9940 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.2029   -0.0386    6.3206 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4801   -1.7084    2.0042 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9634   -0.2081   -5.2084 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9271    3.7371   -0.9250 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0658    2.4092    0.1573 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.5722   -0.1336   -2.9129 N   0  0  0  0  0  2  0  0  0  0  0  0
   18.3682    0.3076    5.7095 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.4114   -0.4396    3.0076 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8762    3.1254   -0.1680 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.2432    0.1078   -0.3478 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.0757   -3.8305   -3.1666 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.5984   -1.8796    1.1923 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.8469    0.1607   -4.2571 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2826   -3.9280   -0.3912 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4266    3.1079   -2.6197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4612    0.5650    0.4804 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3256    0.5772   -0.8230 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.2878   -1.3268    3.4399 O   0  0  0  0  0  1  0  0  0  0  0  0
  -10.3402   -1.0178   -2.9011 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.9957    0.0731   -0.5265 N   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9420   -0.2820    2.5453 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.4702   -1.3978    1.1319 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.5630   -2.9375    4.1352 O   0  0  0  0  0  1  0  0  0  0  0  0
   12.2483    0.7313   -5.0829 F   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0384   -3.6068    1.9844 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.3331   -5.2069    2.3900 O   0  0  0  0  0  1  0  0  0  0  0  0
  -15.1556   -7.0342    0.4432 O   0  0  0  0  0  1  0  0  0  0  0  0
  -13.5628   -0.6272   -2.9732 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.9902    1.2047   -1.5034 C   0  0  0  0  0  1  0  0  0  0  0  0
  -16.0694   -1.7259    4.9199 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  2  4  1  0
  3  5  2  0
  4  7  1  0
  4  8  2  0
  5  8  1  0
  6 10  1  0
  6 71  1  0
  9 10  1  0
  9 67  2  0
  9 78  1  0
 10 34  2  0
 11 35  1  0
 11 71  1  0
 11 77  2  0
 12 26  1  0
 12 80  1  0
 12  7  1  0
 13 84  1  0
 13 81  1  0
 14 28  1  0
 14 83  1  0
 15 28  1  0
 15 29  1  0
 16 24  1  0
 16 29  1  0
 17 30  1  0
 17 68  2  0
 17 79  1  0
 18 25  1  0
 18 79  1  0
 19 31  1  0
 19 69  2  0
 19 80  1  0
 20 32  1  0
 20 70  2  0
 20 81  1  0
 21 27  1  0
 21 84  1  0
 22 27  1  0
 22 72  2  0
 22 82  1  0
 23 73  2  0
 23 83  1  0
 23 98  1  0
 24 74  1  0
 24 85  2  0
 25 75  1  0
 25 86  2  0
 26 76  1  0
 26 87  2  0
 27 39  1  0
 27 40  1  0
 30 45  1  0
 30 74  1  0
 31 75  1  0
 32 76  1  0
 33 44  1  0
 33 78  1  0
 34 35  1  0
 34 41  1  0
 35 88  1  6
 36 38  1  0
 37 41  2  0
 37 49  1  0
 37 78  1  0
 38 35  1  0
 42 46  1  0
 42 83  1  0
 42 89  2  0
 43 48  1  0
 43 50  1  0
 43 82  1  0
 44 49  2  0
 44 50  1  0
 45 47  1  0
 46 99  1  0
 47 51  1  0
 48 52  1  0
 49 90  1  0
 50 53  2  0
 51 91  1  0
 51 92  2  0
 52 54  1  0
 53 54  1  0
 53 55  1  0
 54 58  2  0
 55 59  1  0
 55 90  2  0
 56 60  1  0
 56 62  1  0
 56100  1  0
 57 91  1  0
 58 61  1  0
 58 63  1  0
 59 61  2  0
 60 57  1  0
 60 95  1  0
 61 94  1  0
 62 64  1  0
 62 93  1  0
 64 65  1  0
 64 96  1  0
 65 66  1  0
 65 95  1  0
 66 97  1  0
 98 46  1  0
M  RAD  8   1   2   2   2   3   2   5   2   6   3   7   3   8   2  12   2
M  RAD  8  13   3  14   3  15   3  16   3  18   3  21   3  28   3  29   3
M  RAD  8  30   2  31   3  32   3  33   3  36   2  38   3  39   2  40   2
M  RAD  8  41   2  43   2  45   3  46   2  47   3  48   3  52   3  56   2
M  RAD  8  57   3  59   2  60   2  62   2  63   2  64   2  65   2  66   3
M  RAD  8  74   2  75   2  76   2  79   2  80   2  81   2  82   2  88   2
M  RAD  7  91   2  93   2  96   2  97   2  98   3  99   2 100   2
M  END
$$$$
