LYLIN0006
     RDKit          3D

 81 85  0  0  1  0  0  0  0  0999 V2000
    8.6643    0.5223    0.6214 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.8847    1.1990   -1.8801 C   0  0  0  0  0  1  0  0  0  0  0  0
   15.9276   -1.3073    0.7769 C   0  0  0  0  0  3  0  0  0  0  0  0
   17.5817   -0.4564    2.4009 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.9951    0.1009   -0.7844 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.6539   -1.4943    0.3440 C   0  0  0  0  0  3  0  0  0  0  0  0
   16.1746   -0.4168    1.8234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4939    2.1395    1.5691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2819    2.2401    3.8897 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.4016   -1.8866   -0.3407 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.2171   -1.0730   -0.5656 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.6234   -1.2671   -1.0482 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.7784   -1.7830   -0.4208 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5655   -0.7556    0.8439 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.1508    0.3898    2.3332 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.9074    1.8933    0.1950 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.0227    1.0033    2.4856 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.3663    1.5782    0.4932 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.3577   -1.4140   -0.5239 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.8226   -2.2316   -1.0407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9851    1.1072    0.8744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4041    2.1750    0.4301 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.5446    1.1053    4.5524 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.2112    0.2925    3.6110 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.5602    1.4427   -0.9113 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.0293   -0.0735   -1.1940 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8724   -1.4760   -0.6961 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.9258   -1.3148   -1.5591 C   0  0  0  0  0  3  0  0  0  0  0  0
   13.8025    0.1343    1.8698 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.5416   -0.4798   -2.5852 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.5736    0.3993   -3.3197 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.3076    3.5083   -2.4118 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.5614    1.5917   -3.6451 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.6046    1.2761    1.4948 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3633   -0.0235    0.0953 O   0  0  0  0  0  1  0  0  0  0  0  0
   12.1852   -2.9714   -0.3390 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.8621   -0.6425    2.9578 O   0  0  0  0  0  1  0  0  0  0  0  0
    9.7106   -1.7964   -1.9970 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.3525    0.1335    4.6437 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4258    1.0941   -1.6270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9271    2.8355    2.6450 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.3132   -0.7650    0.3152 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.2855   -1.7144   -1.1290 N   0  0  0  0  0  2  0  0  0  0  0  0
    2.4830    1.9828    1.7543 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1454   -2.3774   -0.0314 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6668    0.5558    1.9658 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9264   -3.2816   -0.4131 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0773    4.4121   -2.0816 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.5072    2.7013   -3.5250 N   0  0  0  0  0  2  0  0  0  0  0  0
   13.0735    3.3770   -1.6608 N   0  0  0  0  0  1  0  0  0  0  0  0
  -15.6190   -2.7983   -2.1332 C   0  0  0  0  0  2  0  0  0  0  0  0
  -14.3712   -4.1490   -1.0428 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.6733   -4.0246    0.2965 C   0  0  0  0  0  2  0  0  0  0  0  0
  -16.4411   -1.6831   -1.5209 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.3740   -2.9201    2.6072 C   0  0  0  0  0  3  0  0  0  0  0  0
  -16.4930    0.2809   -0.5972 C   0  0  0  0  0  2  0  0  0  0  0  0
  -13.0546   -1.5211    1.6618 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.0997   -2.7744    3.0899 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.2330   -0.3239    1.3072 C   0  0  0  0  0  2  0  0  0  0  0  0
  -15.6868    1.5753   -0.3593 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.9501   -2.0065    1.6933 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.3970   -1.6752    2.6169 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.3104   -0.8345    1.3049 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0174   -0.7269    1.7123 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9180    0.2293    0.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4831    1.0647   -0.5612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2011    1.4086   -1.2706 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8613    1.5521   -0.8394 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5122    1.8020   -2.6083 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.9277    2.0844   -1.7498 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.6149    2.4360   -3.4527 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.3098    2.5829   -3.0115 C   0  0  0  0  0  3  0  0  0  0  0  0
  -14.9659   -3.9822   -2.2476 O   0  0  0  0  0  0  0  0  0  0  0  0
  -17.2619   -0.7416   -1.0323 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.3699   -2.9433    1.2995 C   0  0  0  0  0  2  0  0  0  0  0  0
  -15.1695    2.9798   -0.0299 N   0  0  0  0  0  1  0  0  0  0  0  0
  -11.2851    0.5045    0.5356 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.6922    1.3471   -0.4619 N   0  0  0  0  0  0  0  0  0  0  0  0
  -10.6013    1.6958   -1.0994 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3785    1.0426    0.4150 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1961    0.3300    1.1839 C   0  0  0  0  0  2  0  0  0  0  0  0
  1  5  1  0
  2  5  1  0
  3  6  2  0
  3  7  1  0
  4  7  1  0
  4 37  1  0
  5 12  1  0
  6 14  1  0
  7 15  2  0
  8 22  1  0
  8 34  2  0
  8 41  1  0
  9 23  1  0
  9 41  1  0
 10 27  1  0
 10 45  1  0
 11 27  1  0
 11 35  1  0
 11 43  1  0
 12 20  1  0
 12 43  1  0
 13 28  1  0
 13 36  2  0
 13 42  1  0
 14 29  2  0
 14 42  1  0
 15 29  1  0
 16 21  1  0
 16 22  1  0
 17 24  1  0
 17 44  1  0
 18 25  1  0
 18 44  1  0
 19 26  1  0
 19 45  1  0
 20 38  1  0
 20 47  2  0
 21 46  2  0
 21 80  1  0
 23 39  1  0
 24 39  1  0
 25 40  1  0
 26 40  1  0
 28 30  1  0
 28 38  1  0
 30 31  1  0
 31 33  1  0
 32 48  2  0
 32 49  1  0
 32 50  1  0
 33 49  1  0
 51 54  1  0
 51 73  1  0
 52 53  1  0
 52 73  1  0
 53 75  1  0
 54 74  1  0
 55 58  2  0
 55 61  1  0
 56 60  1  0
 56 74  1  0
 57 59  1  0
 57 75  1  0
 58 62  1  0
 59 77  1  0
 60 76  1  0
 61 63  2  0
 62 64  2  0
 63 64  1  0
 63 65  1  0
 64 81  1  0
 65 66  2  0
 65 77  1  0
 66 67  1  0
 66 79  1  0
 67 68  2  0
 67 69  1  0
 68 70  1  0
 68 80  1  0
 69 71  2  0
 70 72  2  0
 71 72  1  0
 77 78  1  0
 78 79  2  0
 81 80  1  0
M  RAD  8   1   2   2   2   3   2   4   3   5   2   6   2   9   3  10   3
M  RAD  8  11   2  12   2  15   2  16   3  17   3  18   3  19   3  22   3
M  RAD  8  23   3  24   3  25   3  26   3  27   3  28   2  29   2  30   3
M  RAD  8  31   3  33   3  35   2  37   2  38   2  41   2  42   2  43   2
M  RAD  8  49   2  50   3  51   3  52   3  53   3  54   3  55   2  56   3
M  RAD  8  57   3  58   2  59   3  60   3  61   2  62   2  69   2  70   2
M  RAD  5  71   2  72   2  75   3  76   3  81   3
M  END
$$$$
