TJL0242
     RDKit          3D

128132  0  0  1  0  0  0  0  0999 V2000
    7.1152   -0.8538   -3.2974 C   0  0  0  0  0  1  0  0  0  0  0  0
   11.1018    0.8342    2.2589 C   0  0  0  0  0  1  0  0  0  0  0  0
   10.3726   -1.3002    0.9559 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.6186   -2.1093   -3.1272 C   0  0  0  0  0  1  0  0  0  0  0  0
   16.2249    0.5583   -3.5086 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6049   -1.0002   -2.5828 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.4637    0.1336    0.9824 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.8343    0.7863   -2.8459 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.1771   -2.8380    0.8001 C   0  0  0  0  0  1  0  0  0  0  0  0
   16.5156   -0.3414   -2.3016 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.4890    2.9663    0.5549 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.6517   -0.7137   -1.1845 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.6182    4.1809   -1.7422 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.9313   -0.3088    2.8074 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.7382   -2.4501    2.0640 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.0639   -1.6934    0.3285 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0481    1.9922    1.0712 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9806    0.9080   -0.1733 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.2080    1.0542   -1.3290 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.5700   -0.4283   -1.2095 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.5349    2.8036   -0.7824 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.5309    0.6654   -0.6577 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.4429    0.7149   -0.7678 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9964    0.6993    2.4797 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.6210   -1.6313    2.5295 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5367    1.9245    0.9949 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.8105    0.9277   -1.4183 C   0  0  0  0  0  3  0  0  0  0  0  0
   16.2743   -3.8044   -0.9772 C   0  0  0  0  0  1  0  0  0  0  0  0
   15.5517   -1.4176   -0.1921 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.9457    0.2345   -2.3360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2814    2.1254   -0.8711 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.2461    0.3692    1.9444 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3574   -2.0025    2.0177 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.5649   -2.5381    0.0962 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.8786    3.2592    0.8727 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.2653    2.1289   -1.4846 C   0  0  0  0  0  1  0  0  0  0  0  0
  -10.9890   -4.3598    0.8630 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.5734   -2.2575    1.1073 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.1272    2.2990    1.0959 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3443   -4.7011    0.6735 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.5671   -2.3984   -0.1619 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.1679   -0.8513    1.1449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8182   -0.5111   -1.2592 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.2263    2.2431    0.2736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9475    2.2816   -0.1895 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.3322    3.9182    2.1953 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.8715   -5.0828    1.2675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0384   -3.6932    0.8723 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.5448   -0.9740    1.7820 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.6203    4.4284    0.1369 C   0  0  0  0  0  1  0  0  0  0  0  0
  -14.3738   -4.5652   -0.2698 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.7339   -2.3151    0.7388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1528   -0.7109   -1.6043 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.8094    1.2542   -1.1838 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.2893   -3.6601   -1.0809 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.7558   -3.9122   -1.4097 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.9645    0.0723   -2.2051 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.4439   -0.0312   -1.7561 C   0  0  0  0  0  2  0  0  0  0  0  0
   19.2077   -0.5366    0.5168 C   0  0  0  0  0  3  0  0  0  0  0  0
   19.5581    0.8651    0.9310 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.4828    0.9176   -1.6343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2105   -1.4360   -2.4793 C   0  0  0  0  0  2  0  0  0  0  0  0
   20.5539    1.7688    0.1577 C   0  0  0  0  0  0  0  0  0  0  0  0
   21.3254    1.4056   -0.9592 C   0  0  0  0  0  3  0  0  0  0  0  0
   20.6137    3.1462    0.4746 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.9183   -3.2313   -1.1096 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6554    0.2231    0.2835 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.1026    0.1535    1.6216 C   0  0  0  0  0  3  0  0  0  0  0  0
   22.1025    2.3454   -1.6541 C   0  0  0  0  0  3  0  0  0  0  0  0
   21.4654    4.0877   -0.1460 C   0  0  0  0  0  3  0  0  0  0  0  0
   22.1432    3.6657   -1.3176 C   0  0  0  0  0  3  0  0  0  0  0  0
  -16.8065    1.9085   -1.3881 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.6358    0.9398   -0.3419 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.4920    3.9162   -0.1631 C   0  0  0  0  0  2  0  0  0  0  0  0
  -17.0953    4.6861    0.8849 C   0  0  0  0  0  0  0  0  0  0  0  0
  -16.7231    4.1766   -2.5205 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.1820   -0.9364   -0.1281 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.5497    1.9320    2.2055 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3182    0.7183    0.4163 N   0  0  0  0  0  2  0  0  0  0  0  0
   14.5605    0.5475   -1.4852 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1008   -0.0943   -3.5330 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6050    3.3761    1.4743 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3245   -1.7474   -0.2893 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.7436    1.6436   -0.1235 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8941   -2.6007    1.3930 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3810   -5.4823    1.6424 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6805   -5.0477    0.5884 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.5609   -0.2811    0.1020 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1467    2.9481   -0.1601 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.7518    1.5175   -1.0717 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2545    1.2454    1.9576 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.0132    1.1910   -1.8692 N   0  0  0  0  0  2  0  0  0  0  0  0
  -12.1720   -4.0717    0.2247 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5458    1.8583    1.4138 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0885   -1.0780    1.1139 N   0  0  0  0  0  2  0  0  0  0  0  0
  -10.0023   -5.9247    2.1980 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2661   -0.2950    2.2798 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.0754   -3.2890    1.3914 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.1569    1.2896    2.0526 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.4778   -3.4976   -1.9805 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4294   -2.9157   -2.3108 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.6754    0.4211   -1.2187 N   0  0  0  0  0  2  0  0  0  0  0  0
  -10.2228    2.1072   -1.7882 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6964   -4.2325   -0.4670 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7294   -2.1950   -0.4631 N   0  0  0  0  0  1  0  0  0  0  0  0
  -17.4764    1.4399   -2.3666 O   0  0  0  0  0  0  0  0  0  0  0  0
  -16.5991   -0.1054    0.4609 N   0  0  0  0  0  0  0  0  0  0  0  0
  -16.4763    3.2354   -1.3247 N   0  0  0  0  0  0  0  0  0  0  0  0
  -16.7075    6.1052    0.9941 N   0  0  0  0  0  1  0  0  0  0  0  0
  -18.1157    4.3478    1.5237 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.4188   -4.1106   -2.7911 C   0  0  0  0  0  1  0  0  0  0  0  0
   10.1998    0.8015   -2.6522 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.2055   -1.0225    1.0780 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.8874   -1.2227   -0.7216 C   0  0  0  0  0  1  0  0  0  0  0  0
   10.8119   -0.2667   -3.3796 C   0  0  0  0  0  1  0  0  0  0  0  0
   13.4247    0.6991    0.4644 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.4292   -2.0146    1.7532 C   0  0  0  0  0  1  0  0  0  0  0  0
  -12.2076    1.3945    2.4750 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.5709    2.0375    2.6641 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.7510    1.1235    2.3760 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.4261   -0.0507    1.5632 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.1997   -0.6846    1.7462 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5959    1.2009    3.6213 O   0  0  0  0  0  1  0  0  0  0  0  0
  -15.6468    0.9554    3.3037 O   0  0  0  0  0  1  0  0  0  0  0  0
  -13.6644    3.2550    2.2428 O   0  0  0  0  0  1  0  0  0  0  0  0
  -17.9350   -0.8517    0.4002 C   0  0  0  0  0  1  0  0  0  0  0  0
  -15.3615   -0.7942    0.6670 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.0896   -1.8898    0.0671 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0
  3  7  1  0
  3  9  1  0
  4  6  1  0
  5  8  1  0
  5 10  1  0
  7  2  1  0
  7 18  1  0
  8 80  1  0
 11 21  1  0
 12 22  1  0
 12 83  1  0
 12  6  1  0
 13 21  1  0
 14 24  2  0
 14 25  1  0
 15 25  1  0
 15 85  1  0
 16 77  2  0
 16 83  1  0
 16 85  1  0
 17 78  2  0
 17 84  1  0
 18 27  1  0
 18 84  1  0
 19 23  1  0
 20 29  1  0
 20 80  1  0
 20 10  1  0
 22 79  1  0
 22 90  2  0
 23 80  1  0
 23116  2  0
 24 32  1  0
 25 33  2  0
 26 17  1  0
 26 35  1  0
 26 79  1  0
 27 19  1  0
 27112  1  0
 29 41  1  0
 29113  1  0
 30 43  1  0
 30 81  2  0
 30 92  1  0
 31 44  1  0
 31 92  1  0
 31 21  1  0
 32 49  2  0
 32 91  1  0
 33 49  1  0
 34 83  1  0
 35 46  1  0
 35 50  1  0
 36 84  1  0
 37 47  1  0
 37 93  1  0
 38 42  1  0
 38 48  1  0
 39 45  1  0
 39 82  2  0
 39 91  1  0
 40 51  1  0
 40 86  2  0
 40 93  1  0
 41 28  1  0
 41 52  1  0
 42 88  1  0
 42 97  2  0
 43 88  1  0
 44 89  1  0
 44 94  2  0
 45 54  1  0
 45 89  1  0
 47 87  1  0
 47 96  2  0
 48 87  1  0
 51 56  1  0
 52 95  1  0
 52 98  2  0
 53 43  1  0
 53 58  1  0
 54 57  1  0
 55 56  1  0
 55 93  1  0
 55100  2  0
 56111  1  0
 57 62  1  0
 58 61  1  0
 59 60  1  0
 59 95  1  0
 59114  1  0
 60 63  1  0
 60 99  1  0
 61102  1  0
 61103  2  0
 62101  1  0
 63 64  2  0
 63 65  1  0
 64 69  1  0
 65 70  2  0
 66101  1  0
 66104  2  0
 66105  1  0
 67102  1  0
 68 67  1  0
 68118  1  0
 69 71  2  0
 70 71  1  0
 72 73  1  0
 72106  2  0
 72108  1  0
 73107  1  0
 74 75  1  0
 74108  1  0
 75109  1  0
 75110  2  0
 76108  1  0
107126  1  0
107127  1  0
112115  1  0
113117  1  0
118119  1  0
118123  1  0
119120  1  0
119125  1  0
120121  1  0
120124  1  0
121122  1  0
122 68  1  0
127128  2  0
127121  1  0
M  RAD  8   1   2   2   2   3   3   4   2   5   3   6   2   7   2   8   3
M  RAD  8   9   2  10   3  11   2  12   2  13   2  14   2  15   3  18   2
M  RAD  8  19   3  20   2  21   2  24   2  26   2  27   2  28   2  29   2
M  RAD  8  31   2  33   2  34   2  35   2  36   2  37   3  38   3  41   2
M  RAD  8  43   2  45   2  46   2  48   3  49   2  50   2  51   3  53   3
M  RAD  8  54   3  56   2  57   3  58   3  59   2  60   2  62   3  64   2
M  RAD  8  65   2  67   3  68   2  69   2  70   2  71   2  73   3  74   3
M  RAD  8  76   2  79   2  87   2  88   2  89   2  91   2  92   2  95   2
M  RAD  8  99   2 101   2 102   2 105   3 109   3 111   2 114   2 115   2
M  RAD  8 117   2 118   2 119   2 120   2 121   2 123   2 124   2 125   2
M  RAD  1 126   2
M  END
$$$$
