TJL0467
     RDKit          3D

 76 82  0  0  1  0  0  0  0  0999 V2000
  -14.4259    1.3632    1.4783 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.7761    1.9782    0.2974 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.5902    2.8817   -1.2207 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.7099    0.3740    2.7979 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.1034    0.9433    1.5823 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6448   -0.6283    3.9277 C   0  0  0  0  0  2  0  0  0  0  0  0
  -11.4019   -0.0145    2.9000 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.8445    2.1723   -0.7587 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1285    1.1360    0.5292 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.5316    1.7728   -0.6437 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.5263    0.1826    1.8364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2519   -1.3685    4.2921 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2344   -0.3420    2.2825 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9405   -1.3746    3.5238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7222   -1.8855    3.9596 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.0691   -0.4325    1.7476 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.8361   -0.9372    2.2441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9587    0.4348    1.7963 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.4579   -0.9244    1.5020 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.5628   -2.1449    2.0927 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8377    1.9412    2.2107 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.8483   -1.4304   -3.6226 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8174   -1.2271   -0.7659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5252   -2.1037   -3.2402 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.3376   -1.3671   -2.1576 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.3632   -0.2638   -2.9577 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.8139    0.1406   -2.9381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4588   -0.9440   -2.2332 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.4774   -2.2277   -2.4037 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.9684   -3.3667   -1.4294 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.3922   -2.1598   -3.7049 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.3488    1.1141   -1.1136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7039    0.6412    1.3002 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.2770    0.9624   -0.0461 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.3010    0.2891    2.7147 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5511    1.6303   -1.3666 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3854   -0.1397   -0.0947 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.9896    1.8509   -1.2845 C   0  0  0  0  0  2  0  0  0  0  0  0
   22.4823   -0.3311    1.0333 C   0  0  0  0  0  2  0  0  0  0  0  0
   20.4480    0.0663   -1.2128 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5020    2.2136   -1.2451 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.7376   -0.2033   -1.9543 C   0  0  0  0  0  0  0  0  0  0  0  0
   23.5869   -0.5062    2.1214 C   0  0  0  0  0  0  0  0  0  0  0  0
   18.0657    0.2452   -1.4795 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.6144    1.6802   -1.0466 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.4009    0.2906   -2.1262 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.9803    0.0205   -2.6883 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.7043    0.6295   -0.7555 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.6551   -0.1882   -1.2748 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.8441   -0.1489   -2.2779 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.0366    2.4697   -0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4200    2.8264   -1.8416 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3509   -1.8276    5.4351 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3441   -0.8234    3.5990 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.8448    0.7525    0.6689 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5302   -2.2148    3.4828 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8391   -1.0778    0.1095 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6441   -0.8735   -3.2366 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.6455   -1.2544   -0.4511 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3539    0.0688   -2.0400 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1993    1.2896   -2.7314 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1208    2.0817   -1.0771 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7286    0.7814    3.7415 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.0154    1.9513   -2.4178 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0704    1.1302   -0.2308 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.3453   -0.4499    2.7285 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.3332    0.7223   -0.8394 N   0  0  0  0  0  2  0  0  0  0  0  0
   16.6563   -1.3001   -2.5164 O   0  0  0  0  0  0  0  0  0  0  0  0
   23.4098   -1.4118    3.0027 O   0  0  0  0  0  1  0  0  0  0  0  0
   15.7578    0.6612   -1.6504 N   0  0  0  0  0  2  0  0  0  0  0  0
   20.8521   -0.2461   -2.3387 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.7515    2.6578   -1.2941 O   0  0  0  0  0  0  0  0  0  0  0  0
   24.6019    0.2549    2.0337 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6227   -0.2894   -0.4356 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.7784   -0.1609   -3.2296 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2067   -3.1356    1.4436 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  1  5  1  0
  2  8  1  0
  2 51  1  0
  3 51  1  0
  3 52  1  0
  4  5  2  0
  4  7  1  0
  5  9  1  0
  6  7  1  0
  6 54  1  0
  7 11  2  0
  8 10  2  0
  8 52  1  0
  9 10  1  0
  9 55  2  0
 11 13  1  0
 11 55  1  0
 12 14  1  0
 12 53  2  0
 12 54  1  0
 13 16  2  0
 13 54  1  0
 14 15  1  0
 14 17  2  0
 15 56  1  0
 16 17  1  0
 17 19  1  0
 18 21  1  0
 19 20  1  0
 19 57  1  0
 19 18  1  6
 20 56  1  0
 20 76  2  0
 22 24  1  0
 23 57  1  0
 23 59  2  0
 24 28  1  0
 25 23  1  0
 25 29  1  0
 25 58  1  0
 26 22  1  0
 26 27  1  0
 26 60  1  0
 27 58  1  0
 27 61  2  0
 28 60  1  0
 29 30  1  0
 29 31  1  0
 32 34  1  0
 32 60  1  0
 32 62  2  0
 33 35  1  0
 34 33  1  0
 34 65  1  0
 35 63  1  0
 35 66  2  0
 36 38  1  0
 36 64  2  0
 36 65  1  0
 37 39  1  0
 37 40  1  0
 38 41  1  0
 39 43  1  0
 40 67  1  0
 40 71  2  0
 41 72  1  0
 42 44  1  0
 42 68  2  0
 42 70  1  0
 43 69  1  0
 43 73  2  0
 44 67  1  0
 45 48  1  0
 45 72  1  0
 46 47  1  0
 46 70  1  0
 47 75  1  0
 48 74  1  0
 49 50  1  0
 49 74  1  0
 50 75  1  0
M  RAD  8   1   2   3   3   4   2   6   3  10   2  15   3  16   2  18   3
M  RAD  8  21   2  22   3  24   3  25   2  26   2  28   3  29   2  30   2
M  RAD  8  31   2  33   3  34   2  37   3  38   3  39   3  41   3  44   3
M  RAD  8  45   3  46   3  47   3  48   3  49   3  50   3  58   2  63   2
M  RAD  4  65   2  67   2  69   2  70   2
M  END
$$$$
