SCPAY0045
     RDKit          3D

 50 52  0  0  1  0  0  0  0  0999 V2000
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   -9.0814    2.9853    0.7692 C   0  0  0  0  0  2  0  0  0  0  0  0
   -7.3705    1.1386    1.2626 C   0  0  0  0  0  2  0  0  0  0  0  0
   -5.5437   -0.6036    1.1894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5337    1.9525    1.5858 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.2422   -0.2126    2.9146 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.1079   -0.9213   -0.6168 C   0  0  0  0  0  3  0  0  0  0  0  0
   -5.9888   -2.0889   -1.8948 C   0  0  0  0  0  1  0  0  0  0  0  0
   -8.4792    0.5353    3.4322 C   0  0  0  0  0  2  0  0  0  0  0  0
   -2.7451   -0.4711   -0.5106 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.5283   -2.2537   -1.2905 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0801    1.8897    0.0005 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.6014   -0.1010   -0.4212 C   0  0  0  0  0  3  0  0  0  0  0  0
   -3.5481   -2.5402   -2.3614 C   0  0  0  0  0  2  0  0  0  0  0  0
   -4.7270   -4.6225   -0.6446 C   0  0  0  0  0  1  0  0  0  0  0  0
   -0.2544    0.3716   -0.2957 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.3637   -2.7310   -3.3259 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.6323    2.0511    1.7328 C   0  0  0  0  0  3  0  0  0  0  0  0
   12.3497    4.9285    1.4095 C   0  0  0  0  0  1  0  0  0  0  0  0
   10.0009    0.5654    0.3393 C   0  0  0  0  0  3  0  0  0  0  0  0
    8.1424   -1.0784    0.6469 C   0  0  0  0  0  2  0  0  0  0  0  0
    5.7988   -1.6742    0.1804 C   0  0  0  0  0  3  0  0  0  0  0  0
    3.1348   -1.0078    0.4208 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.8995   -0.5144   -0.3876 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.7814   -1.1314   -2.6128 C   0  0  0  0  0  0  0  0  0  0  0  0
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    9.0719   -0.1377    1.1620 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.2200   -2.0892    0.0982 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.9721    3.4252    1.5810 C   0  0  0  0  0  2  0  0  0  0  0  0
   11.2643    1.2354    0.5764 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.6361   -1.3688    0.2567 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.8895   -0.7028    0.6525 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0449   -1.9721   -3.4292 C   0  0  0  0  0  2  0  0  0  0  0  0
    7.6125   -2.4495   -1.3695 C   0  0  0  0  0  1  0  0  0  0  0  0
   12.2507    1.2547   -0.6758 C   0  0  0  0  0  1  0  0  0  0  0  0
    1.4804   -0.6680    2.1577 C   0  0  0  0  0  1  0  0  0  0  0  0
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   -5.0098   -1.5816    1.7207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6186    0.0846    1.7379 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1072   -0.0993   -0.0210 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1870    1.6628    2.7715 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4835   -3.2719   -0.2577 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2659   -0.0843   -3.0203 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8365    1.4811    2.8375 O   0  0  0  0  0  1  0  0  0  0  0  0
    8.8917    1.1862    0.8688 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8005   -1.5759   -1.3154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8835   -3.5392   -4.8946 O   0  0  0  0  0  1  0  0  0  0  0  0
    7.3644   -3.1882    0.8076 O   0  0  0  0  0  1  0  0  0  0  0  0
  -10.3489    5.1823   -2.1586 O   0  0  0  0  0  0  0  0  0  0  0  0
  -11.0957    6.1213   -0.2366 O   0  0  0  0  0  1  0  0  0  0  0  0
  1  2  1  0
  1 37  1  0
  2  5  1  0
  3  5  1  0
  3 39  1  0
  4 38  2  0
  4 39  1  0
  4 40  1  0
  5 41  1  0
  6  9  1  0
  6 39  1  0
  7 10  1  0
  7 11  1  0
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  9 41  1  0
 10 13  2  0
 11  8  1  6
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 13 16  1  0
 14 17  1  0
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 17 26  1  0
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 20 27  1  0
 20 30  1  0
 20 45  1  0
 21 28  1  0
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 27 21  1  0
 27 45  1  0
 28 34  1  6
 28 48  1  0
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 32 36  1  0
 37 49  2  0
 37 50  1  0
M  RAD  8   1   3   2   3   3   3   5   2   6   3   7   2   8   2   9   3
M  RAD  8  10   2  12   2  13   2  14   3  15   2  16   2  17   3  18   2
M  RAD  8  19   2  20   2  21   3  22   2  23   2  24   2  26   2  27   2
M  RAD  8  29   3  30   2  31   2  33   3  34   2  35   2  36   2  41   2
M  RAD  4  44   2  47   2  48   2  50   2
M  END
$$$$
