
     RDKit          3D

 84 87  0  0  0  0  0  0  0  0999 V2000
    5.8170    1.1203   -0.6149 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3969    0.8425   -0.4000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5933    1.8011    0.3644 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9825    2.8449   -0.5687 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3532    3.8729    0.1885 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1155    3.7006    0.8167 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0722    3.6520    2.2138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1420    3.4612    2.8766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3244    3.3400    2.1457 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2956    3.4134    0.7511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0785    3.5800    0.0732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0761    3.7196   -1.3988 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5312    4.6920   -1.9198 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7322    2.7676   -2.2476 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9329    1.3671   -1.8648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3503    1.1686   -1.4015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2981    1.6487   -2.0813 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6216    0.4277   -0.2015 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9543    0.3685    0.4050 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7217   -0.9474    0.0570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9092   -2.1474    0.5970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8484   -1.0678   -1.4804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1381   -0.9794    0.6820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9866   -2.0864    0.4430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2765   -2.1415    0.9805 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7508   -1.0987    1.7742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.9983   -1.1609    2.3022 F   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9304   -0.0043    2.0425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6395    0.0590    1.5074 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6184    0.4426   -3.0572 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4135   -1.0267   -2.6465 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0147   -1.2977   -2.2716 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8146   -1.6833   -3.1645 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4644   -1.0798   -0.9220 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.8554   -1.2054   -0.4625 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3700   -2.6494   -0.6079 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7013   -2.8215    0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7573   -2.9639    1.4791 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9903   -3.0396    2.1312 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1796   -2.9739    1.3994 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4003   -3.0364    2.0645 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.1311   -2.8344    0.0061 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8989   -2.7557   -0.6496 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7622   -0.2067   -1.1504 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0498   -0.3521   -2.3698 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3223    0.2651   -1.1099 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3143    1.2889    0.3621 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9367    2.0275   -1.2448 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7839    1.2828    0.9211 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2340    2.3158    1.1109 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2593    2.3589   -1.2587 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7829    3.3091   -1.1800 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9858    3.7466    2.7865 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1654    3.4180    3.9580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2679    3.2066    2.6571 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2281    3.3711    0.2043 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9371    3.0492   -3.2339 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2330    1.1228   -1.0374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8235   -0.0023    0.3199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5442    1.2558    0.0872 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8264    0.4368    1.5059 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8904   -2.1710    0.1564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3918   -3.1143    0.3421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8158   -2.0817    1.7031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3631   -2.0033   -1.7793 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4246   -0.2106   -1.8884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8512   -1.0915   -1.9658 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6576   -2.9180   -0.1638 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.9096   -2.9950    0.7763 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2959    0.8043    2.6636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0575    0.9326    1.7543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4511    0.4964   -3.7946 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2923    0.8110   -3.5825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0876   -1.3132   -1.8137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6798   -1.6750   -3.5066 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7481   -0.8301   -0.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8637   -0.9794    0.6266 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4606   -2.9265   -1.6795 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6313   -3.3452   -0.1508 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8434   -3.0008    2.0611 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0232   -3.1472    3.2070 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2803   -3.0163    1.5622 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0471   -2.7746   -0.5676 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8777   -2.6336   -1.7266 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  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 16 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 20 22  1  0
 20 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 26 28  1  0
 28 29  2  0
 15 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  2  0
 32 34  1  0
 34 35  1  0
 35 36  1  0
 36 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  2  0
 40 41  1  0
 40 42  1  0
 42 43  2  0
 35 44  1  0
 44 45  2  0
 44  2  1  0
 11  6  1  0
 29 23  1  0
 43 37  1  0
  1 46  1  0
  1 47  1  0
  1 48  1  0
  3 49  1  0
  3 50  1  0
  4 51  1  0
  4 52  1  0
  7 53  1  0
  8 54  1  0
  9 55  1  0
 10 56  1  0
 14 57  1  0
 15 58  1  0
 18 59  1  0
 19 60  1  0
 19 61  1  0
 21 62  1  0
 21 63  1  0
 21 64  1  0
 22 65  1  0
 22 66  1  0
 22 67  1  0
 24 68  1  0
 25 69  1  0
 28 70  1  0
 29 71  1  0
 30 72  1  0
 30 73  1  0
 31 74  1  0
 31 75  1  0
 34 76  1  0
 35 77  1  0
 36 78  1  0
 36 79  1  0
 38 80  1  0
 39 81  1  0
 41 82  1  0
 42 83  1  0
 43 84  1  0
M  END
$$$$
