TJLLIN0146
     RDKit          3D

 45 45  0  0  1  0  0  0  0  0999 V2000
  -10.6655    3.0458   -1.4666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2287    2.8711   -1.0233 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.0767    5.0191    0.0525 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.6430    4.1717   -1.1601 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.0830   -1.5313    1.0027 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.1882    0.6922   -0.2108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3143    4.8708   -2.5437 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.3882   -0.4355    0.3712 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.4550   -2.7961    1.5934 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.2172   -2.0391    1.1115 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.3773    1.5709   -0.4644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8755   -0.3031   -0.0633 C   0  0  0  0  0  0  0  0  0  0  0  0
   15.9873    1.2710   -0.6257 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.4958    0.9106   -0.7696 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.5855   -1.1332    0.2268 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.3336   -1.7278    1.5240 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.6340   -2.0318   -0.6639 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0170    0.5041   -0.8779 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.6304    0.0937   -0.9376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1051   -2.3763    2.9377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4669   -1.4563   -0.0115 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.1990   -0.9096    0.6898 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.0448   -1.4792   -0.1643 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.6052   -1.9349    0.1785 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9102   -0.4541    0.5135 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1608   -0.4093   -0.3928 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.4445   -1.7058   -0.0144 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.2428   -0.9603   -0.6389 C   0  0  0  0  0  2  0  0  0  0  0  0
  -11.3830    3.7993   -0.7360 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5286    1.8183   -0.4824 N   0  0  0  0  0  2  0  0  0  0  0  0
  -10.4065    0.5005   -0.2884 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.8751    2.6534   -0.7366 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.2436    0.5156    0.0564 N   0  0  0  0  0  1  0  0  0  0  0  0
   -7.0478   -0.8420    0.4726 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7929    0.7007   -0.7726 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4967   -3.1477   -1.1716 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.8335    0.8646   -1.4604 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6858   -1.2265   -0.7983 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.9130   -2.4150    3.3869 O   0  0  0  0  0  1  0  0  0  0  0  0
   -5.1306   -2.8270    3.5422 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4504   -1.1136   -0.4016 N   0  0  0  0  0  2  0  0  0  0  0  0
    0.8706   -0.4485    1.3355 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4216   -2.4168    0.5464 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2176   -0.3294   -1.1979 O   0  0  0  0  0  0  0  0  0  0  0  0
  -10.9843    2.5768   -2.5993 O   0  0  0  0  0  1  0  0  0  0  0  0
  1 29  2  0
  1 45  1  0
  2  1  1  0
  2 30  1  0
  2  4  1  0
  3  4  1  0
  4  7  1  0
  5  9  1  0
  6 30  1  0
  6 31  2  0
  8  5  1  0
  8  6  1  0
  8 34  1  0
  9 10  1  0
 10 34  1  0
 11 13  1  0
 11 32  2  0
 11 33  1  0
 12 15  1  0
 12 34  1  0
 12 35  2  0
 13 14  1  0
 14 18  1  0
 15 16  1  0
 15 38  1  0
 16 20  1  0
 17 21  1  0
 17 36  2  0
 17 38  1  0
 18 19  1  0
 19 37  2  0
 19 41  1  0
 20 39  1  0
 20 40  2  0
 21 22  1  0
 22 42  1  0
 23 24  1  0
 23 41  1  0
 24 43  1  0
 25 26  1  0
 25 42  1  0
 26 44  1  0
 27 28  1  0
 27 43  1  0
 28 44  1  0
M  RAD  8   2   2   3   2   4   2   5   3   7   2   8   2   9   3  10   3
M  RAD  8  13   3  14   3  15   2  16   3  18   3  21   3  22   3  23   3
M  RAD  8  24   3  25   3  26   3  27   3  28   3  30   2  33   3  38   2
M  RAD  3  39   2  41   2  45   2
M  END
$$$$
