LYLIN000347
     RDKit          3D

 50 53  0  0  1  0  0  0  0  0999 V2000
   14.3444    1.5431    1.0133 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8146    2.8226    1.0023 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.3921    0.3091    0.9014 C   0  0  0  0  0  2  0  0  0  0  0  0
   12.2658    3.0195    0.8926 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.9394   -0.2299    0.7483 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.8539    2.3739    0.7587 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.4963   -0.1420    0.5968 C   0  0  2  0  0  0  0  0  0  0  0  0
    9.8932    1.2898    0.6111 C   0  0  1  0  0  0  0  0  0  0  0  0
    9.5548    0.2941    1.6171 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.2554   -0.2870    1.6507 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.1120   -0.3443    1.5575 C   0  0  0  0  0  1  0  0  0  0  0  0
    0.5224   -1.1494    0.1530 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.7379   -0.9370   -0.3215 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.9418    0.1131    0.0352 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.9790    0.8667   -1.9111 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.5713   -0.0033    0.0532 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0131   -0.1928    1.0202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1099   -1.3817   -0.6930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4269   -0.7921   -0.6584 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.2471    0.4662   -0.8182 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.6078    0.8053   -0.5603 C   0  0  0  0  0  0  0  0  0  0  0  0
  -14.3091    1.0895   -2.3228 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.9248   -1.8540    0.5424 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.7790   -1.6435   -1.7892 C   0  0  0  0  0  3  0  0  0  0  0  0
  -13.6636    0.9801    0.3527 C   0  0  0  0  0  3  0  0  0  0  0  0
  -15.3288    1.2603   -1.3873 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4320   -3.0856   -1.6419 C   0  0  0  0  0  1  0  0  0  0  0  0
   -5.6758   -1.1697   -3.3052 C   0  0  0  0  0  1  0  0  0  0  0  0
  -14.9961    1.2037   -0.0413 C   0  0  0  0  0  3  0  0  0  0  0  0
  -16.6997    1.4854   -1.7901 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.9554    2.9572    1.1543 N   0  0  0  0  0  0  0  0  0  0  0  0
   15.6882    1.6104    1.1014 N   0  0  0  0  0  0  0  0  0  0  0  0
   14.8163    3.7240    1.0769 N   0  0  0  0  0  3  0  0  0  0  0  0
   10.0680   -0.8438   -0.1164 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0846    1.4898   -0.0902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3109    0.6142    1.0886 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8166   -0.8154    1.0720 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.0898   -2.6053    1.1640 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.1210   -0.6327   -0.1917 N   0  0  0  0  0  2  0  0  0  0  0  0
  -11.3636    0.5732   -0.0500 N   0  0  0  0  0  2  0  0  0  0  0  0
    7.0564   -0.8772    1.6359 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6474   -2.3925    0.7180 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5493   -0.3579   -0.0594 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7402    0.0137   -0.6273 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.1998    0.9826    0.6407 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9087   -2.6833   -0.7000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5153   -3.2457    1.5563 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1929   -2.3602   -1.4326 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1682    0.6423   -2.0394 O   0  0  0  0  0  0  0  0  0  0  0  0
  -18.0527    1.7049   -2.1678 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  1 32  1  0
  2  4  1  0
  2 33  1  0
  3  5  1  0
  4  6  1  0
  5  7  1  0
  6  8  1  0
  7  8  1  0
  7  9  1  0
  7 34  1  6
  8  9  1  0
  8 35  1  6
  9 10  1  0
 10 41  1  0
 12 23  1  0
 12 43  1  0
 13 18  1  0
 13 43  1  0
 14 11  1  0
 14 20  1  0
 14 44  1  0
 15 21  2  0
 15 22  1  0
 16 36  2  0
 16 44  1  0
 17 37  1  0
 17 41  1  0
 17 45  2  0
 18 39  1  0
 18 48  2  0
 19 16  1  0
 19 24  1  0
 19 39  1  0
 20 40  1  0
 20 49  2  0
 21 25  1  0
 21 40  1  0
 22 26  2  0
 23 38  1  0
 24 27  1  0
 24 28  1  0
 25 29  2  0
 26 29  1  0
 26 30  1  0
 30 50  1  0
 31 32  2  0
 31 33  1  0
 37 42  1  0
 38 42  1  0
 42 46  2  0
 42 47  2  0
M  RAD  8   3   3   4   3   5   3   6   3   9   2  10   3  11   2  12   3
M  RAD  8  13   3  14   2  15   2  19   2  22   2  23   3  24   2  25   2
M  RAD  8  27   2  28   2  29   2  30   3  33   2  37   2  38   2  39   2
M  RAD  3  40   2  44   2  50   2
M  END
$$$$
