TJLLIN0080
     RDKit          3D

 54 55  0  0  1  0  0  0  0  0999 V2000
    3.3314   -1.1112    1.9073 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.3200   -3.7488    1.5760 C   0  0  0  0  0  1  0  0  0  0  0  0
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    1.1284   -1.8195   -0.9298 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8582   -3.0676   -1.9144 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -0.4306    0.4882   -3.4428 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.2291   -2.5749   -0.5587 C   0  0  0  0  0  3  0  0  0  0  0  0
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    0.1398   10.4771    1.2487 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.0379    8.5461    2.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
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    8.1872   -2.4081    0.5220 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.2266    9.9702    2.3260 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.0182   -1.3798   -1.3042 C   0  0  0  0  0  2  0  0  0  0  0  0
    9.3180   -2.2369    1.6232 C   0  0  0  0  0  2  0  0  0  0  0  0
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   12.5469   -2.6525    3.7628 C   0  0  0  0  0  0  0  0  0  0  0  0
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    7.9355   -4.3346   -2.0712 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.4335   -0.3665   -2.9002 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.9133   -2.2804   -0.2576 N   0  0  0  0  0  2  0  0  0  0  0  0
   -0.1936    8.2632    0.8987 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4094   -1.8196   -1.4113 N   0  0  0  0  0  2  0  0  0  0  0  0
    8.4682   -2.1785   -2.6082 O   0  0  0  0  0  1  0  0  0  0  0  0
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    5.0593   -2.4772   -2.4088 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0811    7.8435    3.2211 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.4896   -2.6035    4.5497 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2381   -0.5710   -0.8347 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8582   -2.7825   -1.4405 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.5130   -1.8148    3.7374 N   0  0  0  0  0  2  0  0  0  0  0  0
   12.6598   -3.7489    2.7739 N   0  0  0  0  0  1  0  0  0  0  0  0
   -8.5941   -2.3848   -0.4137 O   0  0  0  0  0  0  0  0  0  0  0  0
  -12.1402   -4.2159    2.0779 N   0  0  0  0  0  1  0  0  0  0  0  0
   -9.3670    0.9605    0.0381 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.7322   -0.8868   -0.5898 O   0  0  0  0  0  1  0  0  0  0  0  0
  -11.4422   -5.7632    0.5233 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0
  2  3  1  0
  4  3  1  0
  4 13  1  0
  4 40  1  0
  5 15  1  0
  5 39  1  0
  6 15  1  0
  6 16  1  0
  7 11  1  0
  7 16  1  0
  8 12  1  0
  8 35  2  0
  8 40  1  0
  9 14  1  0
  9 34  2  0
  9 41  1  0
 10 17  1  0
 10 36  2  0
 10 39  1  0
 11 37  1  0
 11 42  2  0
 12 19  1  0
 12 37  1  0
 13 38  1  0
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 17 21  2  0
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 19 22  1  0
 20 23  1  0
 22 24  1  0
 23 25  1  0
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 30 33  1  0
 31 32  1  0
 31 52  1  0
 32 53  1  0
 33 51  1  0
 33 54  2  0
M  RAD  8   1   2   2   2   3   2   4   2   5   3   6   3   7   3  12   2
M  RAD  8  14   2  15   3  16   3  17   2  19   3  20   3  21   2  22   3
M  RAD  8  23   3  25   3  27   3  28   2  29   2  30   3  31   2  32   2
M  RAD  8  37   2  38   2  40   2  41   2  46   2  48   2  49   3  51   3
M  RAD  2  52   2  53   2
M  END
$$$$
