SC0401
     RDKit          3D

 79 85  0  0  1  0  0  0  0  0999 V2000
    3.5791   -0.9195   -0.5871 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.6698    1.7889    0.0285 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3327    3.2156    0.9660 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.9016    0.2509    0.1458 C   0  0  0  0  0  2  0  0  0  0  0  0
   15.9348    1.0015   -0.8962 C   0  0  0  0  0  0  0  0  0  0  0  0
   16.0495    3.0413    0.1328 C   0  0  0  0  0  3  0  0  0  0  0  0
   11.1235   -2.0622   -2.4708 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.1385   -4.1510   -0.3648 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.9268   -2.6500    1.0079 C   0  0  0  0  0  2  0  0  0  0  0  0
    6.4885    1.1598    0.3164 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2704    1.3388    1.0070 C   0  0  0  0  0  3  0  0  0  0  0  0
   -0.2405    1.3654    3.7404 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.7017    0.4026   -2.7560 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.1133    0.7305    2.5198 C   0  0  0  0  0  2  0  0  0  0  0  0
   14.9127    3.0227   -0.8086 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.8178    1.2122   -2.0660 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.6761   -0.7201   -2.9919 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.0046   -3.2405   -1.4995 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.6633   -1.8818    1.0899 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6073    0.3190    0.7948 C   0  0  0  0  0  2  0  0  0  0  0  0
    3.1869    1.9342    1.9886 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8920    1.4452    2.7955 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.0435    1.2707    1.4167 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.3786    1.2454   -0.6656 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9480    0.3572   -4.6183 C   0  0  0  0  0  1  0  0  0  0  0  0
   -4.7352   -0.1804   -3.1859 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.6811   -0.8485   -1.8488 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.8507   -2.1930   -2.1809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9950   -0.2691   -0.6469 C   0  0  0  0  0  3  0  0  0  0  0  0
   -6.1439   -1.1323   -1.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.6697    3.4315    2.3792 C   0  0  0  0  0  3  0  0  0  0  0  0
  -10.7156    4.1457    2.9660 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.9094    2.2939    1.6230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2302   -0.3452   -0.3198 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7932   -2.2612   -1.7438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8889   -3.1288   -2.3757 C   0  0  0  0  0  2  0  0  0  0  0  0
   -9.1529    0.5369    0.3939 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.0335    3.7319    2.7863 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.2536    1.8315    1.4757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2848   -2.4705   -1.5482 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.4151   -0.0248    0.2402 C   0  0  0  0  0  0  0  0  0  0  0  0
  -12.2836    2.5766    2.0495 C   0  0  0  0  0  3  0  0  0  0  0  0
  -11.4973    0.6467    0.7393 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.2371   -1.2296   -0.5014 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.8092    0.1804    0.4522 C   0  0  0  0  0  3  0  0  0  0  0  0
  -16.4198   -2.1757    1.9918 C   0  0  0  0  0  1  0  0  0  0  0  0
  -15.9022   -1.3003    0.7906 C   0  0  0  0  0  0  0  0  0  0  0  0
  -15.9231   -2.1829   -0.5074 C   0  0  0  0  0  1  0  0  0  0  0  0
  -16.8107   -0.0533    0.6488 C   0  0  0  0  0  1  0  0  0  0  0  0
   16.3503   -0.0924   -1.2452 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.4528   -5.3145   -0.6256 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5653    1.5032   -0.8579 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2894    2.1493    4.6988 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8276   -0.5468    1.1233 N   0  0  0  0  0  2  0  0  0  0  0  0
    1.9766    1.3631    1.7600 N   0  0  0  0  0  2  0  0  0  0  0  0
   14.8246    1.7212   -1.3095 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8700    1.8509    0.5033 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1594    1.7961   -1.4457 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.1158   -3.5762    0.8489 N   0  0  0  0  0  2  0  0  0  0  0  0
    5.6061    1.5876    1.2360 N   0  0  0  0  0  2  0  0  0  0  0  0
   -1.1005    0.3626    3.5319 N   0  0  0  0  0  2  0  0  0  0  0  0
   -2.6282   -2.2731   -2.1822 O   0  0  0  0  0  0  0  0  0  0  0  0
   14.2423    4.0091   -1.0834 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.6330   -2.5712    1.1128 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4591    2.8387    2.7868 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0136   -0.0758   -0.8435 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6005   -3.2737   -2.6337 O   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8708    1.6636    1.0533 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9400   -1.4633   -0.8326 N   0  0  0  0  0  0  0  0  0  0  0  0
   -8.8356   -3.4621   -2.0213 O   0  0  0  0  0  0  0  0  0  0  0  0
  -13.9160   -0.1169    0.1593 N   0  0  0  0  0  0  0  0  0  0  0  0
  -14.5369   -0.9376    1.1515 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8427   -2.1639   -0.0067 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.5086   -3.3533   -0.6637 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.9399   -3.2658   -1.9235 C   0  0  0  0  0  3  0  0  0  0  0  0
    2.7070   -2.0394   -2.5305 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.0295   -0.8568   -1.8567 C   0  0  0  0  0  3  0  0  0  0  0  0
   16.5076    4.5195    0.8477 S   0  0  0  0  0  0  0  0  0  0  0  0
   18.3195    4.3998    0.7255 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  4  1  0
  1 73  2  0
  2  5  1  0
  2  6  1  0
  3 57  1  0
  5 50  2  0
  5 56  1  0
  6 15  1  0
  6 78  1  0
  7 17  1  0
  7 18  1  0
  8 18  1  0
  8 51  2  0
  8 59  1  0
  9 19  1  0
  9 59  1  0
 10 20  1  0
 10 52  2  0
 10 60  1  0
 11  4  1  0
 11 21  1  0
 11 60  1  0
 12 22  1  0
 12 53  2  0
 12 61  1  0
 13 16  1  0
 13 17  1  0
 14 23  1  0
 14 61  1  0
 15 56  1  0
 15 63  2  0
 16 56  1  0
 19 54  1  0
 19 64  2  0
 20 54  1  0
 21 55  1  0
 21 65  2  0
 22 55  1  0
 23 57  1  0
 24 57  1  0
 24 58  2  0
 24 66  1  0
 25 26  1  0
 27 26  1  6
 27 28  1  0
 27 30  1  0
 27 66  1  0
 28 62  2  0
 28 67  1  0
 29 30  1  0
 29 34  2  0
 30 35  2  0
 31 32  2  0
 31 33  1  0
 32 38  1  0
 33 39  1  0
 33 68  2  0
 34 37  1  0
 34 69  1  0
 35 36  1  0
 35 40  1  0
 36 67  1  0
 37 41  2  0
 37 68  1  0
 38 42  2  0
 39 42  1  0
 39 43  2  0
 40 69  1  0
 40 70  2  0
 41 43  1  0
 41 44  1  0
 43 45  1  0
 44 69  1  0
 45 71  2  0
 46 47  1  0
 47 48  1  0
 47 49  1  0
 47 72  1  0
 71 72  1  0
 73 74  1  0
 74 75  2  0
 75 76  1  0
 76 77  2  0
 77  1  1  0
 79 78  1  0
M  RAD  8   2   3   3   2   4   3   6   2   7   3   9   3  11   2  13   3
M  RAD  8  14   3  16   3  17   3  18   3  20   3  22   3  23   3  25   2
M  RAD  8  26   3  29   2  31   2  32   2  36   3  38   2  42   2  44   3
M  RAD  8  45   2  46   2  48   2  49   2  54   2  55   2  59   2  60   2
M  RAD  7  61   2  73   2  74   2  75   2  76   2  77   2  79   2
M  END
$$$$
