YSWLIN0039
     RDKit          3D

 90 92  0  0  1  0  0  0  0  0999 V2000
    7.9567    0.3916    3.6117 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7231    2.4764    4.0760 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2823    3.2056    2.7765 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.2674    2.7985    1.9002 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.1074    2.7055    3.6205 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.5366    2.0300   -0.2539 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.9531    1.7385   -2.2999 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.5425    1.9285    1.7319 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.4985    1.6742    0.8424 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.2489   -2.1583   -2.1246 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.3850   -2.3621   -0.4330 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.3546    0.8457   -3.4304 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.3287   -1.0068   -3.1890 C   0  0  0  0  0  2  0  0  0  0  0  0
   21.3550   -2.4331    1.7630 C   0  0  0  0  0  2  0  0  0  0  0  0
   18.3699   -1.4230    0.3471 C   0  0  0  0  0  2  0  0  0  0  0  0
   20.1882   -1.4875    1.3651 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.8862    3.3866    3.9658 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4982    1.2128    4.6470 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.6783    1.2439    1.7765 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.2652    3.6872    1.9669 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4401    0.0572   -4.0267 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.4070    2.3785   -1.2316 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.2526   -0.6394    0.9640 O   0  0  0  0  0  0  0  0  0  0  0  0
   16.4471   -2.9967   -1.1363 O   0  0  0  0  0  0  0  0  0  0  0  0
   22.4007   -3.3652    2.1749 N   0  0  0  0  0  1  0  0  0  0  0  0
    6.5562    0.3889    3.4942 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.9377    0.3375    2.2369 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.7819    0.3485    1.1267 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1838    0.1815    1.2379 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.7584    0.0126    2.5231 C   0  0  0  0  0  3  0  0  0  0  0  0
  -16.7000    3.1092    0.7488 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.5605    3.1217   -0.0703 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.9219   -4.6886    4.3984 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.7210    2.1369    0.6690 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.3641    2.1743   -1.0574 C   0  0  0  0  0  3  0  0  0  0  0  0
  -17.5814    1.2250   -0.4051 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6275   -4.3113    2.5556 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.4062    1.2370   -1.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8526   -3.8830    1.0302 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.4499    0.1652   -2.0214 C   0  0  0  0  0  0  0  0  0  0  0  0
  -17.6209   -0.5160   -1.7258 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.1447   -3.3584   -0.4328 C   0  0  0  0  0  2  0  0  0  0  0  0
  -15.3141   -0.2082   -3.0537 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.1720   -1.2204   -1.6513 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.0626   -0.9446   -1.5271 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.4421    1.3227    1.2204 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7642    2.8544    1.8019 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.5105    2.2831   -1.9308 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.2582   -1.8882   -1.9592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4554   -2.7756   -1.7422 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.4461   -2.0556   -3.6193 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.0798   -0.3993   -3.8074 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.4554    1.2844    0.0312 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3373   -0.2933   -1.2861 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.0631    0.1215   -1.0911 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.3991    1.1836    0.1327 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4333    3.9023    0.8993 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.8335    3.5562   -1.1227 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.1289    1.0430   -2.5973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7025   -0.4717   -1.7951 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.8080   -3.1057   -2.4228 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0599   -2.2108   -3.1104 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.7916    0.7393   -4.8692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7818    0.1231   -0.4698 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.9222    0.5431    0.9748 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.2369    0.8258    2.4519 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9461    0.1594    3.8898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5068   -6.0251    4.5752 N   0  0  0  0  0  1  0  0  0  0  0  0
   -8.7884   -3.5442    4.5342 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.6283   -4.5785    4.0331 N   0  0  0  0  0  2  0  0  0  0  0  0
  -18.3781    0.1963   -0.8413 N   0  0  0  0  0  3  0  0  0  0  0  0
   -4.5563   -2.7311   -1.3566 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.9525   -2.9434   -4.3463 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3164    0.8122   -1.2070 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0601    0.1086   -2.8516 N   0  0  0  0  0  2  0  0  0  0  0  0
   -9.6986   -2.0547   -2.4592 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.5770    1.3271   -0.7608 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0080    4.4795   -0.1447 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3093    0.4604   -6.0241 O   0  0  0  0  0  1  0  0  0  0  0  0
    3.0008   -1.7733   -2.0403 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4974   -1.9769   -2.4690 N   0  0  0  0  0  2  0  0  0  0  0  0
  -13.1065   -1.0017   -3.0658 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1140    1.7846    2.2631 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4841    2.5104    0.3515 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0100    0.9766   -3.1132 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9937   -4.2344   -2.8661 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.2574    1.9304   -4.5413 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7850    0.8672    3.8181 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2922   -0.8820    2.9085 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8520    0.3540    5.0329 N   0  0  0  0  0  1  0  0  0  0  0  0
  1 18  1  0
  1 26  2  0
  2  5  1  0
  2 17  2  0
  2 18  1  0
  3  5  1  0
  3 20  1  0
  4  8  1  0
  4 20  1  0
  6  9  1  0
  6 22  1  0
  7 12  1  0
  7 22  1  0
  8 19  1  0
  9 19  1  0
 10 13  1  0
 10 24  1  0
 11 15  1  0
 11 24  1  0
 12 21  1  0
 13 21  1  0
 14 16  1  0
 14 25  1  0
 15 23  1  0
 16 23  1  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30  1  1  0
 31 32  2  0
 31 34  1  0
 32 35  1  0
 33 68  1  0
 33 69  2  0
 33 70  1  0
 34 36  2  0
 35 38  2  0
 36 38  1  0
 36 71  1  0
 37 39  1  0
 37 70  1  0
 38 40  1  0
 39 42  1  0
 40 41  2  0
 40 43  1  0
 41 71  1  0
 42 50  1  0
 43 52  1  0
 44 54  1  0
 44 80  1  0
 45 55  1  0
 45 80  1  0
 46 56  1  0
 46 83  1  0
 47 57  1  0
 47 83  1  0
 48 58  1  0
 48 59  1  0
 49 60  1  0
 49 72  2  0
 49 81  1  0
 50 61  1  0
 50 81  1  0
 51 62  1  0
 51 73  2  0
 51 82  1  0
 52 63  1  0
 52 82  1  0
 53 74  1  0
 53 84  2  0
 53 28  1  0
 54 74  1  0
 55 77  1  0
 56 77  1  0
 57 78  1  0
 58 78  1  0
 59 75  1  0
 59 85  2  0
 60 64  1  0
 60 75  1  0
 61 76  1  0
 61 86  2  0
 62 76  1  0
 63 79  1  0
 63 87  2  0
 64 65  1  0
 65 66  1  0
 66 88  1  0
 67 88  1  0
 67 89  2  0
 67 90  1  0
M  RAD  8   3   3   4   3   5   3   6   3   7   3   8   3   9   3  10   3
M  RAD  8  11   3  12   3  13   3  14   3  15   3  16   3  25   3  26   2
M  RAD  8  27   2  29   2  30   2  31   2  32   2  34   2  35   2  37   3
M  RAD  8  39   3  41   2  42   3  43   3  44   3  45   3  46   3  47   3
M  RAD  8  48   3  50   2  52   2  54   3  55   3  56   3  57   3  58   3
M  RAD  8  60   2  62   3  64   3  65   3  66   3  68   3  69   2  70   2
M  RAD  8  71   2  74   2  75   2  76   2  79   2  81   2  82   2  88   2
M  RAD  2  89   2  90   3
M  END
$$$$
