cxylin0005
     RDKit          3D

 46 47  0  0  1  0  0  0  0  0999 V2000
   -8.9487    2.1456   -1.0854 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.2411    1.8981   -1.5543 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.1356    1.0796   -0.6949 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.7258    0.5879   -1.6181 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.6255   -0.2289   -0.7616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9193   -0.4781   -1.2256 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.8046   -1.3224   -0.3582 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9601   -2.4031    0.0568 C   0  0  0  0  0  3  0  0  0  0  0  0
    9.2643    0.2200   -1.3689 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.2157    1.7248   -3.7826 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1656    3.4754   -2.5567 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.8800    4.4517   -0.3802 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.8515    4.0667    0.2895 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.1049    2.1407    1.7879 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1858    1.5531    2.1585 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.0459   -1.0801   -0.0386 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1755    0.6675    0.9959 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6705   -3.7723    0.2644 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7691    0.8770   -2.6791 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.2902    3.6745   -1.3024 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.3716    4.0249   -0.3126 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9187    3.1276    1.0959 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.2876    0.5454    2.1923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1937   -0.2227    0.8295 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.6193    0.0790    2.1764 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.2309   -1.2667    0.2789 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9882   -1.1931    1.6914 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.7528    1.1679   -4.7387 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6378    1.0554    1.9978 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0354   -0.7724   -1.2330 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8622    1.6785    1.0666 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3256    0.8810    1.4090 N   0  0  0  0  0  2  0  0  0  0  0  0
    7.6458    3.6870   -0.1341 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8813   -0.1148   -0.1137 N   0  0  0  0  0  0  0  0  0  0  0  0
   10.0437    3.0507   -3.6687 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.6214    4.8870   -0.4345 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1119    2.5987    2.0851 N   0  0  0  0  0  2  0  0  0  0  0  0
   -5.6951   -2.1239    0.5302 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1616   -0.4051    2.9584 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8159   -3.7695    0.7384 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.9374   -2.2563   -0.3780 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9896   -4.8288   -0.2233 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.8277   -6.0562   -0.5741 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.6415   -7.3504   -0.9928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1251   -7.4071   -2.1816 O   0  0  0  0  0  1  0  0  0  0  0  0
   -8.7545   -8.2940   -0.1318 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  1  3  1  0
  2  4  1  0
  3  5  2  0
  4  6  2  0
  5  6  1  0
  5  7  1  0
  8  7  1  0
  8 18  1  0
  8 38  1  0
  9 19  1  0
  9 34  1  0
 10 19  1  0
 10 28  2  0
 10 35  1  0
 11 20  1  0
 11 35  1  0
 12 21  1  0
 12 36  1  0
 13 22  1  0
 13 36  1  0
 14 22  1  0
 14 29  2  0
 14 37  1  0
 15 23  1  0
 15 37  1  0
 16 24  1  0
 16 30  2  0
 16 38  1  0
 17 25  1  0
 17 31  2  0
 17 34  1  0
 18 40  2  0
 18 42  1  0
 20 33  1  0
 21 33  1  0
 23 32  1  0
 23 39  2  0
 24 32  1  0
 25 27  1  0
 26 27  1  0
 26 34  1  0
 26 41  2  0
 42 43  1  0
 43 44  1  0
 44 45  1  0
 44 46  2  0
M  RAD  8   1   2   2   2   3   2   4   2   6   2   7   3   8   2   9   3
M  RAD  8  11   3  12   3  13   3  15   3  19   3  20   3  21   3  22   3
M  RAD  8  24   3  25   3  27   3  32   2  35   2  37   2  38   2  42   2
M  RAD  2  43   3  45   2
M  END
$$$$
