SCLIN0118
     RDKit          3D

 36 36  0  0  1  0  0  0  0  0999 V2000
   -1.8162    2.2805    4.0092 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.6069    3.6488    2.1050 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.2319    2.2504    2.5319 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.9856    0.4396   -3.7780 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.4117    0.5982   -4.2178 C   0  0  0  0  0  2  0  0  0  0  0  0
   -6.9140    0.2014   -2.8964 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.3016    0.3783   -3.3254 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.9889   -1.0247    0.0149 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1006   -2.1196    1.0224 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.5463    0.1720    0.3663 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.5046   -0.7582    0.2627 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.0441    0.6329    1.9574 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2343    1.0739    1.6716 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.0187   -0.1623   -0.6335 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.5833   -2.3389    1.2566 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.5093   -1.7357    0.9275 C   0  0  0  0  0  2  0  0  0  0  0  0
    2.2354    0.3640    1.1701 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.8208   -0.1389   -0.8720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1034   -0.1037   -1.5408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6007    0.7555    1.0449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.5261    0.0730   -1.9869 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.8979   -0.9444    0.0865 C   0  0  0  0  0  3  0  0  0  0  0  0
   -8.4439   -0.1613   -1.1232 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.0502   -2.5398    0.1156 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.2238    1.0257    3.1053 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1698   -0.8119   -0.2530 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7321   -0.5158    0.6519 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3356    0.5847   -1.7455 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3095   -2.6296    1.5138 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.5070    0.8071   -5.0921 O   0  0  0  0  0  1  0  0  0  0  0  0
   11.5582   -1.9744    0.8542 N   0  0  0  0  0  2  0  0  0  0  0  0
    4.6614    0.0682   -0.3550 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0961    0.3831    1.3088 N   0  0  0  0  0  2  0  0  0  0  0  0
   -6.1315   -0.4035   -0.6343 N   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4545    1.6451    1.0866 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.7483    0.9805   -1.4919 Br  0  0  0  0  0  0  0  0  0  0  0  0
  1  3  1  0
  2  3  1  0
  4  6  2  0
  4  7  1  0
  5  7  1  0
  5 30  1  0
  6 19  1  0
  7 21  2  0
  8 14  1  0
  8 26  2  0
  8 31  1  0
  9 15  1  0
  9 31  1  0
 10 17  1  0
 10 32  1  0
 11 16  1  0
 11 32  1  0
 12 17  1  0
 12 25  2  0
 12 33  1  0
 13  3  1  0
 13 20  1  0
 13 33  1  0
 14 36  1  0
 15 29  1  0
 16 29  1  0
 18 22  1  0
 18 28  2  0
 18 34  1  0
 19 23  2  0
 19 34  1  0
 20 27  1  0
 20 35  2  0
 21 23  1  0
 22 24  1  0
 22 27  1  0
M  RAD  8   1   2   2   2   3   2   4   2   5   3   6   2   9   3  10   3
M  RAD  8  11   3  13   2  14   3  15   3  16   3  17   3  21   2  22   2
M  RAD  7  23   2  24   2  27   2  30   2  31   2  33   2  34   2
M  END
$$$$
