LYLIN000122
     RDKit          3D

156159  0  0  1  0  0  0  0  0999 V2000
    3.7279   -2.2834    6.9040 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.5139   -2.5265    4.9217 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.7851   -0.4938    0.4855 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.8110    0.7548   -0.9937 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.2840   -1.3077    8.0243 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3754   -1.7662    3.5414 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.7971   -1.0743    1.4761 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.5109    1.5130   -2.2306 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8716    3.8744   -2.7957 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0541    3.5911   -2.0962 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2054    5.1559   -2.6720 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.7279    4.4348   -1.0822 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1527    6.5571   -2.4731 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.1942    5.8925   -0.7988 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3489    7.2633   -2.0987 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.6955    7.2128   -1.4046 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2909   -3.2386    6.0458 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7620    0.4576    0.3399 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0203    2.3567   -3.9571 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8728    3.0537   -3.9612 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8288   -0.5822    9.2068 N   0  0  0  0  0  1  0  0  0  0  0  0
    5.4185    2.3938   -2.6922 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0410   -0.8914    2.5909 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9631   -6.1951    1.8313 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.5020   -6.4229    3.9277 C   0  0  0  0  0  1  0  0  0  0  0  0
   -6.0097   -1.4313    3.2275 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.6539    4.8508    5.6969 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.1647    0.0491    4.9876 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9117    2.4063    5.8021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5144   -6.0054    2.3260 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.1252   -2.7191    2.7300 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.2731   -1.2432    4.4808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4463    6.4373    5.7700 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9865    0.0753   -7.0484 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8678   -2.3038   -2.6270 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.3085   -5.4355   -0.5962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6019   -6.5920    1.3986 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.0491   -6.0967    3.3307 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5788   -3.8129    3.3869 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6363   -2.2873    5.0852 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.5934   -4.6488   -1.1239 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.3135   -7.8284    1.9422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6126   -7.1730    2.3444 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.1559   -0.6329   -6.0577 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.4500   -1.7936   -4.0328 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9277   -2.6672   -1.1344 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7658   -3.6041    4.5042 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3219   -5.2610   -2.2049 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8664   -7.4223    0.9256 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0303   -0.0628   -7.9861 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.5411   -5.8232   -3.2405 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6130   -8.3284   -0.3443 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.7173   -1.0419   -8.1968 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.7271   -6.2747   -4.2117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8415   -9.3777   -1.2358 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6453  -10.5510   -1.6240 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3438   -2.1988   -7.7170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3112    6.8726   -2.1407 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3736   -2.6511   -6.3035 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.5928    6.6631   -2.2113 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1625    5.0748   -0.5780 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9717    0.3431    0.4494 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.9341   -1.4921    0.2440 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.8670   -3.1587   -3.9597 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.9141    6.5481   -1.9606 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.6368    3.6245   -0.0765 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.4238    1.5126   -0.3641 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.0160   -1.9218   -1.0335 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2139   -2.4875   -2.7591 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.8603    7.2817   -2.4510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4222   -4.7090   -5.8086 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.1557   -5.9956   -6.3404 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7648    2.6659    2.4106 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.7092    4.9341    1.2258 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.9997    2.9876    6.5598 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.0653    1.2758    5.2165 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.1414    0.6457    4.1612 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.9283   -0.3216    2.0405 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.3901   -1.1701    0.7356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0960   -4.9591   -8.1649 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7718    3.6854    1.6712 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.9073    3.7750    6.7417 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.9086    1.7797    5.9256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4004   -4.1406   -7.7184 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7966   -2.9603   -6.0265 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.6598    1.2208    5.6584 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.2190    0.8712   -4.5472 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.4744    2.3415   -0.8530 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4141    3.5617    1.2094 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.4995    3.9468    5.6023 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6112    3.3701    6.2827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5080   -1.9657   -4.9130 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4402   -0.0675   -4.4120 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.0408    1.5350   -4.5231 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9888    2.3956   -2.3983 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.4739    4.6180    1.8707 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3590    3.5702    4.1021 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.4682    2.0300    5.8679 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.3239    3.0524   -2.7780 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2351    2.1985    3.8304 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7558    3.5171   -3.4253 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2167    0.7131    3.5429 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.2094    3.6300   -4.1046 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4866   -0.8435    3.2518 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2786   -2.8270    4.1036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5800    2.0532    6.9775 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0224    7.1840    4.8805 O   0  0  0  0  0  1  0  0  0  0  0  0
   -1.3348   -5.8651   -1.3082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7486   -6.2285    4.5760 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2635    1.4386    4.8119 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2759    3.5671    5.2627 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.3582   -7.7538    2.7608 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0673   -3.4994   -0.4358 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.9692   -1.4533   -5.2666 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0804    6.9445    6.9193 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0132    0.7679   -7.6491 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3735   -5.6928    0.7776 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.7626   -5.0905    2.8115 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.6520   -8.9046    1.7959 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9125   -2.0599   -0.5892 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9432  -11.4227   -2.2328 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2658   -2.0798   -8.5312 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.5103   -2.1590   -8.2193 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9128   -6.3813   -3.7343 O   0  0  0  0  0  1  0  0  0  0  0  0
   -2.9641  -10.6688   -1.6833 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.8323   -9.4890   -1.1757 N   0  0  0  0  0  1  0  0  0  0  0  0
   -2.4342    7.9379   -2.7978 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4558   -6.6932   -5.4761 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7158    2.6737   -0.2700 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0984   -1.5219   -1.9019 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3680    6.2646   -1.5765 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.4272   -0.6674    1.1737 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2753   -3.7409   -5.2243 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8538    8.5198   -2.6973 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3511   -6.9618   -5.6082 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7568    0.5678    5.2552 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1093   -2.3921    0.6339 O   0  0  0  0  0  1  0  0  0  0  0  0
   -0.3422   -6.1015   -7.7388 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.1159    1.3484   -0.4710 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4972    3.9464    6.3402 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7728    0.8069    4.1367 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.7424    0.8512    2.9608 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.6303    1.6527   -3.3164 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.3442    4.6248    3.1837 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5759   -0.7320   -4.3566 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2224   -0.5499   -0.0605 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4034   -3.7330   -6.9319 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1974    3.4992   -0.2184 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.7367    4.3219    5.9789 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.4997    1.9133   -5.6034 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2905    5.7010    1.2416 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8507   -2.7513    4.6404 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1655    2.8291   -3.8513 O   0  0  0  0  0  1  0  0  0  0  0  0
   -3.2859    4.5513   -5.0001 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7175   -2.2460    2.9969 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.2112   -3.6651    4.9048 N   0  0  0  0  0  1  0  0  0  0  0  0
  1  5  1  0
  1 17  1  0
  2  6  1  0
  2 17  1  0
  3  7  1  0
  3 18  1  0
  4  8  1  0
  4 18  1  0
  5 21  1  0
  6 23  1  0
  7 23  1  0
  8 22  1  0
  9 10  2  0
  9 11  1  0
  9 20  1  0
 10 12  1  0
 10 22  1  0
 11 13  1  0
 12 14  1  0
 13 15  1  0
 13 70  1  0
 14 16  1  0
 15 16  1  0
 19 20  2  0
 19 22  1  0
 24 30  1  0
 25 30  1  0
 26 31  2  0
 26 32  1  0
 27 33  1  0
 27111  1  0
 28 32  1  0
 28110  1  0
 29106  2  0
 29110  1  0
 29111  1  0
 31 39  1  0
 32 40  2  0
 33107  1  0
 33115  2  0
 34 44  1  0
 34116  1  0
 35 45  1  0
 35 46  1  0
 36 41  1  0
 36108  2  0
 36117  1  0
 37 30  1  0
 37 42  1  0
 37117  1  0
 38 43  1  0
 38109  2  0
 38118  1  0
 39 47  2  0
 39118  1  0
 40 47  1  0
 41 48  1  0
 41113  1  0
 42112  1  0
 42119  2  0
 43 49  1  0
 43112  1  0
 44114  1  0
 45114  1  0
 46113  1  0
 46120  2  0
 48 51  1  0
 49 52  1  0
 50 53  1  0
 50116  1  0
 51 54  1  0
 52 55  1  0
 53122  1  0
 54124  1  0
 54128  2  0
 55125  1  0
 56121  2  0
 56125  1  0
 56126  1  0
 57 59  1  0
 57122  1  0
 57123  2  0
 58 65  1  0
 58127  2  0
 58131  1  0
 59133  1  0
 60 65  1  0
 60 70  1  0
 61 66  1  0
 61131  1  0
 62 67  1  0
 62132  1  0
 63 68  1  0
 63132  1  0
 64 69  1  0
 64133  1  0
 66129  1  0
 67129  1  0
 68130  1  0
 69130  1  0
 70134  2  0
 71 72  1  0
 71133  1  0
 72135  2  0
 72138  1  0
 73 81  1  0
 74 81  1  0
 75 82  2  0
 75 83  1  0
 76 83  1  0
 76141  1  0
 77136  2  0
 77141  1  0
 77142  1  0
 78 79  1  0
 78142  1  0
 79137  1  0
 79146  2  0
 80 84  1  0
 80138  1  0
 82 91  1  0
 83 86  2  0
 84147  1  0
 85 92  1  0
 85147  1  0
 86 98  1  0
 87 93  1  0
 87 94  1  0
 88 95  1  0
 88139  2  0
 88148  1  0
 89 81  1  0
 89 96  1  0
 89148  1  0
 90 97  1  0
 90140  2  0
 90149  1  0
 91 98  2  0
 91149  1  0
 92145  1  0
 93145  1  0
 94143  1  0
 94150  2  0
 95 99  1  0
 95143  1  0
 96144  1  0
 96151  2  0
 97100  1  0
 97144  1  0
 99101  1  0
100102  1  0
101103  1  0
102104  1  0
103153  1  0
103154  2  0
104155  1  0
105152  2  0
105155  1  0
105156  1  0
M  RAD  8   1   3   2   3   3   3   4   3   5   3   6   3   7   3   8   3
M  RAD  8  11   3  12   3  13   2  14   3  15   3  16   3  21   3  24   2
M  RAD  8  25   2  26   2  27   3  28   3  30   2  31   2  34   3  35   3
M  RAD  8  37   2  40   2  41   2  43   2  44   3  45   3  47   2  48   3
M  RAD  8  49   3  50   3  51   3  52   3  53   3  55   3  59   3  60   3
M  RAD  8  61   3  62   3  63   3  64   3  65   3  66   3  67   3  68   3
M  RAD  8  69   3  71   3  73   2  74   2  75   2  76   3  78   3  80   3
M  RAD  8  81   2  82   2  84   3  85   3  86   2  87   3  89   2  92   3
M  RAD  8  93   3  95   2  97   2  98   2  99   3 100   3 101   3 102   3
M  RAD  8 104   3 107   2 111   2 112   2 113   2 117   2 118   2 122   2
M  RAD  8 124   2 125   2 126   3 131   2 137   2 138   2 142   2 143   2
M  RAD  6 144   2 148   2 149   2 153   2 155   2 156   3
M  END
$$$$
