
     RDKit          3D

 76 79  0  0  0  0  0  0  0  0999 V2000
    2.9360   -0.3920    2.4804 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5537   -0.0631    1.9102 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4521    1.3864    1.7018 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0561    1.9869    0.4589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0033    2.6684    0.4408 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0077    2.0575   -0.7277 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.8532    0.8615   -0.8088 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2851    0.9030   -0.7914 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8892    2.0058   -0.6970 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9948   -0.3043   -0.8721 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4211   -0.4573   -0.8185 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0904    0.2727   -1.9990 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7201   -1.9599   -0.9302 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9716    0.0610    0.5243 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3109    2.3111   -2.0929 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1851    1.3469   -2.3867 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4537    0.0423   -2.8355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5652   -0.9154   -2.8581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8539   -0.5719   -2.4338 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1604    0.7652   -2.1596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1444    1.7202   -2.1290 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7772   -1.5699   -2.1233 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8265   -1.9923   -0.7942 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8563   -2.8837   -0.3258 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6703   -3.0597    1.0443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4538   -2.3422    1.9637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5375   -1.5833    1.4868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7284   -1.3991    0.1055 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7991   -0.5799   -0.3948 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2427    0.6329    0.2376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5319    1.1766    1.1270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5107    1.2701   -0.1788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9319    2.4865    0.3863 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1383    3.0551   -0.0281 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9133    2.4144   -0.9955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4681    1.2073   -1.5364 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2914    0.6681   -1.1202 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1086   -2.3115    3.4070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0090   -2.0588    4.2525 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7093   -2.5720    3.9079 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3057   -1.9816    3.0303 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4747   -0.5672    2.8443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2630    0.2440    3.4686 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0795   -1.4911    2.5550 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0583    0.0613    3.4872 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7284    0.0094    1.8167 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4242   -0.5984    0.9486 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4853    2.0071    2.5418 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6473    2.9465   -0.5380 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4069   -0.0690   -0.9565 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9837    1.3730   -1.9084 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1774    0.0414   -2.0369 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6274   -0.0455   -2.9579 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8145   -2.1525   -0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3242   -2.3619   -1.8879 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2335   -2.5127   -0.0975 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4344   -0.4195    1.3702 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8512    1.1598    0.6143 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0556   -0.1674    0.6170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9253    3.3542   -2.1118 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0677    2.2490   -2.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4615   -0.2517   -3.0996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3299   -1.9432   -3.1025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1635    1.0466   -1.8708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3853    2.7332   -1.8323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1817   -3.3658   -1.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8788   -3.7159    1.3797 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2006   -1.0949    2.1894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2089   -0.8339   -1.3218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3375    2.9917    1.1373 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4716    3.9918    0.4002 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.8497    2.8470   -1.3223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.0581    0.6980   -2.2868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5865   -2.1631    4.9344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5559   -3.6715    3.9637 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9550   -2.6315    2.5330 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  8 10  1  0
 10 11  1  0
 11 12  1  0
 11 13  1  0
 11 14  1  0
  6 15  1  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 19 22  1  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  1  0
 30 31  2  0
 30 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
 35 36  1  0
 36 37  2  0
 26 38  1  0
 38 39  2  0
 38 40  1  0
 40 41  1  0
 41 42  1  0
 42 43  2  0
 42  2  1  0
 21 16  1  0
 28 23  1  0
 37 32  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  6
  3 48  1  0
  6 49  1  1
  7 50  1  0
 12 51  1  0
 12 52  1  0
 12 53  1  0
 13 54  1  0
 13 55  1  0
 13 56  1  0
 14 57  1  0
 14 58  1  0
 14 59  1  0
 15 60  1  0
 15 61  1  0
 17 62  1  0
 18 63  1  0
 20 64  1  0
 21 65  1  0
 24 66  1  0
 25 67  1  0
 27 68  1  0
 29 69  1  0
 33 70  1  0
 34 71  1  0
 35 72  1  0
 36 73  1  0
 40 74  1  0
 40 75  1  0
 41 76  1  0
M  END
$$$$
