YLP0415
     RDKit          3D

103113  0  0  1  0  0  0  0  0999 V2000
    1.2279    0.4141    5.7268 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.3898    6.4106    7.7985 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.3630   -3.6269    6.9641 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.5735   -9.1666    4.0718 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.9919   -2.9401    4.5679 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0006   -6.7322    2.8220 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.1063   -4.7922    1.0970 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2018   -7.9590    3.4203 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.5948   -0.3248    4.9543 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.3171   -1.6781    4.7890 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.3955   -5.5381    3.9645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4564    1.5283    6.4092 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.6677    4.6373    7.0696 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2621   -4.6151    6.1072 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.9392    2.9533    6.7428 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.3506   -5.3155    7.0235 C   0  0  0  0  0  1  0  0  0  0  0  0
    4.3371   -4.5613    4.6555 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.7053    0.6199    5.3524 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.6875    6.0086    7.4727 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1371  -10.9969    4.1252 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5292    5.2114    7.5841 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6913   -5.5716    2.3009 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.7148  -10.4758    2.8709 N   0  0  0  0  0  1  0  0  0  0  0  0
   -2.6073  -12.0751    4.4900 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6543    5.1504    7.8902 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2186  -10.2894    4.7878 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.9831    0.8482    5.0748 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7704   -4.9918    2.9139 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.1824   -3.5597    1.0499 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2725   -3.8607    3.9244 N   0  0  0  0  0  2  0  0  0  0  0  0
    7.1731   -3.0074    4.8838 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3555    4.2076    7.0633 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2968   -6.6613    4.4693 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7009    4.0307    6.8594 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5357   -5.5957    0.1722 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.0375    0.3049    6.1305 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8116   -6.6337   -4.5863 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.4471   -1.9836   -8.2972 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.4288   -7.2261   -3.3538 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6498   -6.0279   -3.2993 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.9056   -3.3594   -3.9889 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.9333   -2.5916   -4.5438 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.9296   -1.5673   -9.0042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2304   -1.7113   -6.7246 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.0719   -4.8443   -0.9625 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5173   -1.5826   -3.7860 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.6469   -4.0056   -2.0488 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4528   -3.1321   -2.6794 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0892   -1.3443   -2.4829 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.0672   -2.1191   -1.9326 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.2729   -1.3812   -8.3173 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3200   -1.5372   -6.0293 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5187   -2.3078   -3.7902 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8028   -3.0933   -1.5262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4242   -1.3662   -6.9650 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3992   -1.5566   -4.5691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6202   -2.3435   -2.3816 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8182   -1.2305   -6.7637 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.8990   -2.1870    0.3454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3841   -0.8235   -3.9191 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.6101   -1.5757   -1.7489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -1.3588    2.1081 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.1438   -1.1938   -7.9175 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4767   -0.8328   -2.5320 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.1336    0.0898    2.5260 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3508    3.7472    2.5544 C   0  0  0  0  0  1  0  0  0  0  0  0
    5.1008    5.7722   -2.5984 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.7608   -0.8667    2.2432 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.0989    1.1432    2.7328 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.4938    2.7741    1.6868 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.6021    4.8800   -1.9007 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.4253    0.5664    2.7506 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.4493    2.9879    0.2523 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.3837    4.3082   -1.5299 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.8769    5.2410   -3.2318 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7244    2.6074    0.8986 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.4470    3.9991   -2.5030 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9070    5.0114   -4.2208 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3961    4.6626   -6.5149 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.5825    2.8667   -0.5112 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.8985    3.4354   -2.2024 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7223    4.3552   -3.8315 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.5842    5.0474   -7.9388 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.7373    6.6144   -5.9901 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3733    6.1844   -8.3117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8656    3.1732   -1.3094 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.2926   -4.8329   -3.0695 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8363   -1.5656  -10.2301 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8858   -1.7445   -8.0418 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9813   -2.9912   -0.1856 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5247   -1.2441   -8.9200 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8443   -1.9434    1.7473 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7621   -1.4960   -0.4266 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1257    5.6823   -3.6197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9361    2.5101    2.1723 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2363    3.1111   -0.8819 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0389    5.4122   -5.5945 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6536    3.2900   -3.1635 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9679    6.8538   -7.3112 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.1079    7.4191   -5.1284 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4509    6.4591   -9.5037 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7926    7.7233    8.6992 S   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2836    8.7283    8.8295 C   0  0  0  0  0  1  0  0  0  0  0  0
  1 18  1  0
  1 36  1  0
  2 21  1  0
  2102  1  0
  4 26  1  0
  4  8  1  0
  5 30  1  0
  5 31  2  0
  7 35  1  0
  7 29  2  0
  8  6  1  0
  9 27  1  0
 10  5  1  0
 10  9  1  0
 11 28  1  0
 11 17  1  0
 11 33  2  0
 12 15  1  0
 12 36  1  0
 13 34  2  0
 13 32  1  0
 14  3  1  0
 14 16  1  0
 15 32  1  0
 17 30  1  0
 17 14  1  0
 18 27  1  0
 19  2  1  0
 19 13  1  0
 20 23  1  0
 20 24  2  0
 20 26  1  0
 21 25  2  0
 21 32  1  0
 22  6  1  0
 22  7  1  0
 22 28  1  0
 35 45  1  0
 37 39  1  0
 37 40  1  0
 38 89  1  0
 39 40  1  0
 40 87  1  0
 41 42  2  0
 41 48  1  0
 42 46  1  0
 43 51  1  0
 43 88  2  0
 43 89  1  0
 44 52  2  0
 44 89  1  0
 45 47  1  0
 46 49  2  0
 47 48  1  0
 47 54  1  0
 47 87  1  0
 48 50  2  0
 49 50  1  0
 51 55  2  0
 51 91  1  0
 52 55  1  0
 52 56  1  0
 53 56  2  0
 53 57  1  0
 54 57  2  0
 54 90  1  0
 55 58  1  0
 56 60  1  0
 57 61  1  0
 58 63  2  0
 59 90  2  0
 59 92  1  0
 59 93  1  0
 60 64  2  0
 61 64  1  0
 61 93  2  0
 62 65  1  0
 62 92  1  0
 63 91  2  0
 65 69  1  0
 67 94  1  0
 68 72  1  0
 68 92  1  0
 69 72  1  0
 69 95  1  0
 70 66  1  0
 70 73  1  0
 70 95  1  0
 71 74  2  0
 71 75  1  0
 73 96  1  0
 74 77  1  0
 75 78  2  0
 75 94  1  0
 76 80  1  0
 76 95  1  0
 77 81  1  0
 77 82  2  0
 78 82  1  0
 78 97  1  0
 79 83  1  0
 79 97  1  0
 80 86  1  0
 80 96  1  0
 81 96  1  0
 81 98  2  0
 83 85  1  0
 84 97  1  0
 84 99  1  0
 84100  2  0
 85 99  1  0
 85101  2  0
102103  1  0
M  RAD  8   1   3   2   2   3   2   4   3   6   3   8   3   9   3  10   3
M  RAD  8  12   3  14   2  15   3  16   2  17   2  18   3  19   3  22   2
M  RAD  8  23   3  26   2  28   2  30   2  35   2  37   3  38   2  39   3
M  RAD  8  40   2  41   2  42   2  44   2  45   3  46   2  49   2  50   2
M  RAD  8  53   2  58   2  60   2  62   3  64   2  65   3  66   2  67   2
M  RAD  8  68   3  69   2  70   2  71   2  72   3  73   3  74   2  76   3
M  RAD  7  79   3  80   2  82   2  83   3  86   2  99   2 103   2
M  END
$$$$
