TJLLIN0138
     RDKit          3D

 48 48  0  0  1  0  0  0  0  0999 V2000
  -11.1293    1.8514    2.7799 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5708    3.3722    4.5134 C   0  0  0  0  0  1  0  0  0  0  0  0
   -9.7441    2.3272    2.3550 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.4994    3.4463    3.2270 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.9036   -3.0687   -2.6291 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.6271   -4.1747   -3.4839 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0095    0.6249    0.9187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.7295    4.9470    2.8058 C   0  0  0  0  0  1  0  0  0  0  0  0
   -7.0029   -0.9752   -1.1243 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2092   -2.0859   -1.8223 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.9734   -0.4302    1.1305 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.8001   -1.1087    2.3937 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9018   -2.2893    1.0120 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.0648   -1.3758   -1.1283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0834   -2.4584    2.5278 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.6961   -1.3214   -1.6122 C   0  0  0  0  0  2  0  0  0  0  0  0
   -1.2471   -1.3425   -2.1755 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.8960   -0.9262   -1.9260 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.0703   -0.4237   -1.0460 C   0  0  0  0  0  2  0  0  0  0  0  0
   10.2285    2.6526   -0.0697 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4554    1.9190    0.2737 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.7202    1.5768   -1.5573 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.6076    0.5711   -1.9183 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.2221   -0.1463   -0.9306 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.9054    0.8032    1.0421 C   0  0  0  0  0  2  0  0  0  0  0  0
   13.7558    1.7012    0.9487 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5897   -0.2431   -1.6598 C   0  0  0  0  0  2  0  0  0  0  0  0
   16.1685   -0.1111    1.1791 C   0  0  0  0  0  2  0  0  0  0  0  0
   17.4271   -1.0013    1.3419 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1106    2.5271    2.3387 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8214   -5.3064   -2.9275 O   0  0  0  0  0  1  0  0  0  0  0  0
   -9.9956    0.4028    0.2168 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2775    0.0482   -1.7607 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7290    1.7187    1.6567 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.9599   -3.8979   -4.6868 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3146   -1.2613    0.2066 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8463   -2.1221   -1.9153 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.2926   -0.8313   -0.0601 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0422   -1.3995   -2.7520 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6828    3.3328    0.8060 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.8389    2.5377   -1.3461 N   0  0  0  0  0  2  0  0  0  0  0  0
    3.0716    0.0071   -0.2789 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.6341    1.0678    0.6024 N   0  0  0  0  0  2  0  0  0  0  0  0
    6.7186   -0.3311   -2.3548 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.9563    2.8830    1.2195 O   0  0  0  0  0  0  0  0  0  0  0  0
   17.7037   -1.8057    0.3998 O   0  0  0  0  0  0  0  0  0  0  0  0
   18.1018   -0.8455    2.4084 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.1727    0.9652    3.6922 O   0  0  0  0  0  1  0  0  0  0  0  0
  1 30  2  0
  1 48  1  0
  2  4  1  0
  3  1  1  0
  3 34  1  0
  3  4  1  0
  4  8  1  0
  5  6  1  0
  6 31  1  0
  6 35  2  0
  7 32  2  0
  7 34  1  0
  9 10  1  0
  9 33  2  0
  9 36  1  0
 10  5  1  0
 10 37  1  0
 11 12  1  0
 11 36  1  0
 11  7  1  0
 12 15  1  0
 13 15  1  0
 13 36  1  0
 14 16  1  0
 14 37  1  0
 14 38  2  0
 16 17  1  0
 17 39  1  0
 18 19  1  0
 18 39  1  0
 19 42  1  0
 20 21  1  0
 20 40  2  0
 20 41  1  0
 21 43  1  0
 22 23  1  0
 22 41  1  0
 23 44  1  0
 24 27  1  0
 24 42  1  0
 25 26  1  0
 25 28  1  0
 26 43  1  0
 26 45  2  0
 27 44  1  0
 28 29  1  0
 29 46  2  0
 29 47  1  0
M  RAD  8   2   2   3   2   4   2   5   3   8   2  10   2  11   2  12   3
M  RAD  8  13   3  15   3  16   3  17   3  18   3  19   3  21   3  22   3
M  RAD  8  23   3  24   3  25   3  27   3  28   3  31   2  34   2  37   2
M  RAD  4  41   2  43   2  47   2  48   2
M  END
$$$$
