JGF0069 Payload
     RDKit          3D

 54 55  0  0  1  0  0  0  0  0999 V2000
    1.7389   -0.5482   -4.4272 C   0  0  0  0  0  1  0  0  0  0  0  0
    6.9515   -3.9940    1.1336 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.6468   -4.0466   -1.3936 C   0  0  0  0  0  1  0  0  0  0  0  0
    7.6892   -3.2426   -0.0391 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.8266    0.5402   -3.3224 C   0  0  0  0  0  2  0  0  0  0  0  0
    1.9184    1.5514   -2.3210 C   0  0  0  0  0  3  0  0  0  0  0  0
   -2.3371    0.1031    3.7194 C   0  0  0  0  0  2  0  0  0  0  0  0
    8.4819   -2.0525    0.1336 C   0  0  0  0  0  3  0  0  0  0  0  0
   -1.4529    0.3592    2.4930 C   0  0  0  0  0  2  0  0  0  0  0  0
    4.3553    0.3850    0.3069 C   0  0  0  0  0  0  0  0  0  0  0  0
  -11.7040   -0.7672   -1.4859 C   0  0  0  0  0  3  0  0  0  0  0  0
    7.8112   -0.7894    0.6035 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4578    1.2515   -0.9965 C   0  0  0  0  0  3  0  0  0  0  0  0
    5.8348    0.4294    0.5040 C   0  0  0  0  0  3  0  0  0  0  0  0
    0.2440    0.9147    0.1456 C   0  0  0  0  0  2  0  0  0  0  0  0
   -3.4428   -0.1989    2.6966 C   0  0  0  0  0  2  0  0  0  0  0  0
  -12.9155   -0.2072   -1.0941 C   0  0  0  0  0  3  0  0  0  0  0  0
   10.6000   -1.1350   -0.4986 C   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5595   -0.5562   -0.7175 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.6001    1.3676    0.1916 C   0  0  0  0  0  3  0  0  0  0  0  0
   -7.3181   -1.2434    1.3895 C   0  0  0  0  0  1  0  0  0  0  0  0
   -1.1378    0.4891    0.0155 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.4628   -3.3949    0.7473 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.1713   -0.1154    1.2965 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.3621    1.6071    1.1892 C   0  0  0  0  0  3  0  0  0  0  0  0
  -12.9841    0.5565    0.0657 C   0  0  0  0  0  3  0  0  0  0  0  0
    4.6719    1.4268   -2.0601 C   0  0  0  0  0  1  0  0  0  0  0  0
  -10.6036    0.2178    0.4466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0332    0.0334    0.7842 C   0  0  0  0  0  3  0  0  0  0  0  0
    6.6442    2.9315    0.3761 C   0  0  0  0  0  1  0  0  0  0  0  0
   -6.4095    0.2453   -0.8425 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8214    1.9855    2.6294 C   0  0  0  0  0  1  0  0  0  0  0  0
  -11.8357    0.7656    0.8283 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.1470   -0.2880    0.2511 C   0  0  0  0  0  3  0  0  0  0  0  0
   -9.3808    0.4316    1.2745 C   0  0  0  0  0  3  0  0  0  0  0  0
    1.1695    2.6940    2.0976 C   0  0  0  0  0  1  0  0  0  0  0  0
   -5.1837    0.6884   -0.0676 C   0  0  0  0  0  3  0  0  0  0  0  0
   -4.8511    2.2380    0.0821 C   0  0  0  0  0  1  0  0  0  0  0  0
   -3.3961   -2.5146   -0.1041 C   0  0  0  0  0  1  0  0  0  0  0  0
    3.6425   -0.1788    1.1428 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5327   -0.7059    0.2045 N   0  0  0  0  0  2  0  0  0  0  0  0
    9.9891   -0.3566   -1.3021 O   0  0  0  0  0  1  0  0  0  0  0  0
    9.8830   -2.1214    0.1227 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8342    0.2699    1.1895 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.8515    1.0118   -0.8632 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2611   -0.3887   -1.8921 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4127   -0.0193    1.3510 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.8666   -1.1214   -0.3207 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1272    2.1457    1.2171 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5472    0.3466   -1.1301 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5756    0.6565   -0.3391 N   0  0  0  0  0  2  0  0  0  0  0  0
   -4.4577   -1.5758   -0.1752 O   0  0  0  0  0  0  0  0  0  0  0  0
   -9.3860    0.9574    2.4317 O   0  0  0  0  0  1  0  0  0  0  0  0
    1.3321    2.9615   -2.6530 C   0  0  0  0  0  1  0  0  0  0  0  0
  1  5  1  0
  2  4  1  0
  3  4  1  0
  5  6  1  0
  6 13  1  0
  6 54  1  0
  7 16  1  0
  8 12  1  0
  8 43  1  0
  8  4  1  0
  9 44  1  0
  9  7  1  0
 10 40  2  0
 10 45  1  0
 11 17  2  0
 11 19  1  0
 12 41  1  0
 12 47  2  0
 13 20  1  0
 13 45  1  0
 14 10  1  0
 14 25  1  0
 14 41  1  0
 15 22  1  0
 17 26  1  0
 18 42  1  0
 18 43  1  0
 18 48  2  0
 19 28  2  0
 20 15  1  0
 20 49  1  0
 22 44  1  0
 22 50  2  0
 23 43  1  0
 24 34  1  0
 24 44  1  0
 24 16  1  0
 25 30  1  0
 25 32  1  0
 26 33  2  0
 27 45  1  0
 28 33  1  0
 28 35  1  0
 29 21  1  0
 29 35  1  0
 29 51  1  0
 31 37  1  0
 31 46  2  0
 31 51  1  0
 34 52  1  0
 35 53  1  0
 36 49  1  0
 37 38  1  0
 37 34  1  0
 39 52  1  0
M  RAD  8   1   2   2   2   3   2   4   2   5   3   6   2   7   3   8   2
M  RAD  8   9   3  11   2  13   2  14   2  15   3  16   3  17   2  19   2
M  RAD  8  20   2  21   2  23   2  24   2  25   2  26   2  27   2  29   2
M  RAD  8  30   2  32   2  33   2  34   2  35   2  36   2  37   2  38   2
M  RAD  6  39   2  41   2  42   2  51   2  53   2  54   2
M  END
$$$$
