TJLLIN0139
     RDKit          3D

 50 50  0  0  1  0  0  0  0  0999 V2000
   -5.6251    2.3380    2.3378 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6423    1.1030    1.6190 C   0  0  0  0  0  2  0  0  0  0  0  0
   -0.9897   -2.7510   -0.5935 C   0  0  0  0  0  1  0  0  0  0  0  0
   -6.9689   -0.6755    0.4008 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6278   -0.0807    0.8246 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.2907   -0.1524    0.6791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2590    1.2483   -1.1715 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1924   -0.7713   -0.0412 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.8550   -1.0333   -2.9961 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.5249   -0.1925    0.3023 C   0  0  0  0  0  2  0  0  0  0  0  0
    0.1816   -0.7442   -0.2424 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.8581    0.1807   -0.1037 C   0  0  0  0  0  2  0  0  0  0  0  0
   -8.9916    0.0174   -0.9276 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.0104    2.0561   -2.2348 C   0  0  0  0  0  2  0  0  0  0  0  0
  -10.1486   -0.6944   -0.2991 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0437    0.1020   -1.0977 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.8173   -0.1408   -0.7821 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.1261    1.0580   -1.9115 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.4112   -0.0803   -1.4349 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.5863    1.7547    1.1133 C   0  0  0  0  0  1  0  0  0  0  0  0
   11.1569   -0.5293   -1.0037 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.5663   -1.9108    1.4858 C   0  0  0  0  0  1  0  0  0  0  0  0
   12.4921   -0.3699   -0.4169 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.4468   -0.9502   -0.7250 C   0  0  0  0  0  3  0  0  0  0  0  0
   16.0973    0.3178    0.1677 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.9096   -0.7620    0.6233 C   0  0  0  0  0  3  0  0  0  0  0  0
   14.8841   -0.1069   -0.5390 C   0  0  0  0  0  0  0  0  0  0  0  0
  -13.6685   -1.1480   -1.6138 C   0  0  0  0  0  0  0  0  0  0  0  0
   17.4358    0.7615    0.8532 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.9651    0.6460    1.3469 C   0  0  0  0  0  1  0  0  0  0  0  0
   18.7804    1.1986    1.5018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2268    3.5407    1.6074 N   0  0  0  0  0  1  0  0  0  0  0  0
   -5.9621    2.4638    3.5092 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2913   -1.7907    0.7991 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9826    0.7235    1.4814 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4863   -0.6413    0.3412 N   0  0  0  0  0  2  0  0  0  0  0  0
   -7.6801    0.1631   -0.4579 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0584   -1.3038   -0.7944 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7740    0.3192    0.8758 N   0  0  0  0  0  0  0  0  0  0  0  0
   11.0724   -0.9974   -2.1385 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.1140    0.0891   -2.0956 N   0  0  0  0  0  0  0  0  0  0  0  0
  -11.1564   -0.8288   -1.1820 N   0  0  0  0  0  2  0  0  0  0  0  0
   13.8103   -0.1872    0.2582 N   0  0  0  0  0  2  0  0  0  0  0  0
   10.1728   -0.1318   -0.1865 N   0  0  0  0  0  2  0  0  0  0  0  0
  -13.6198   -2.0916   -2.4631 O   0  0  0  0  0  0  0  0  0  0  0  0
   15.0137   -0.3600   -1.7345 O   0  0  0  0  0  0  0  0  0  0  0  0
  -14.6365   -0.3443   -1.4384 O   0  0  0  0  0  1  0  0  0  0  0  0
   18.7918    2.3080    2.1207 O   0  0  0  0  0  0  0  0  0  0  0  0
   19.7750    0.4170    1.3601 O   0  0  0  0  0  1  0  0  0  0  0  0
  -10.1192   -1.0360    0.8803 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  1 32  1  0
  1 33  2  0
  3 38  1  0
  4  5  1  0
  4 34  2  0
  4 37  1  0
  5 36  1  0
  5  2  1  0
  6  8  1  0
  6 35  2  0
  6 36  1  0
  7 14  1  0
  7 37  1  0
  8 38  1  0
  9 41  1  0
 10 11  1  0
 10 39  1  0
 11 38  1  0
 12 16  1  0
 12 39  1  0
 13 15  1  0
 13 18  1  0
 13 37  1  0
 14 18  1  0
 15 42  1  0
 15 50  2  0
 16 41  1  0
 17 19  1  0
 17 44  1  0
 19 41  1  0
 20 39  1  0
 21 23  1  0
 21 40  2  0
 21 44  1  0
 22 26  1  0
 23 43  1  0
 24 28  1  0
 24 42  1  0
 24 26  1  0
 25 27  1  0
 25 29  1  0
 26 30  1  0
 27 43  1  0
 27 46  2  0
 28 45  2  0
 28 47  1  0
 29 31  1  0
 31 48  2  0
 31 49  1  0
M  RAD  8   2   3   3   2   5   2   7   3   8   3   9   2  10   3  11   3
M  RAD  8  12   3  13   2  14   3  16   3  17   3  18   3  19   3  20   2
M  RAD  8  22   2  23   3  24   2  25   3  26   2  29   3  30   2  32   3
M  RAD  6  36   2  42   2  43   2  44   2  47   2  49   2
M  END
$$$$
