
     RDKit          3D

 66 69  0  0  0  0  0  0  0  0999 V2000
    5.7250    0.7273    0.7021 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4211    0.5168    1.4686 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2968    0.3480    0.5341 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4312    1.4960    0.2026 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7310    2.1136    1.4336 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0419    1.0871    2.3643 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4898    1.0630    2.2425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9411    0.6190    0.9103 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3286    1.6190   -0.0616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8218    1.5972   -1.2155 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3440    2.6520    0.2557 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2963    2.4420    1.2712 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2609    3.4155    1.5515 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2934    4.6038    0.8138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5121    5.8199    1.1582 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.3521    4.8231   -0.1962 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3848    3.8515   -0.4776 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1563   -0.8265    0.6488 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4629   -1.0697   -0.1437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8798   -2.5193   -0.1263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6563   -3.3427   -1.2445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0580   -4.6808   -1.2225 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6798   -5.2075   -0.0853 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8955   -4.3987    1.0352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4936   -3.0610    1.0178 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0704   -1.4542   -0.0398 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3430   -0.7841   -1.2657 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4761   -0.9532   -2.0784 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2519   -1.0170   -3.4605 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3150   -1.1615   -4.3531 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6222   -1.2270   -3.8768 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8711   -1.1412   -2.5070 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8137   -0.9921   -1.5933 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1762   -0.9128   -0.1655 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4989   -1.9825    0.4201 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9122   -0.1185    0.0041 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6752    1.6785    0.1243 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5733    0.7885    1.4159 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5102   -0.3790    2.1247 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2660    1.3881    2.1389 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0455    2.2769   -0.2941 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6493    1.2050   -0.5166 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9971    2.8710    1.0808 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4756    2.6915    2.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4518    0.0669    2.2448 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2765    1.3737    3.4126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8791    2.0764    2.4790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8990    0.3904    3.0280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3044    1.5233    1.8409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9897    3.2371    2.3309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3742    5.7423   -0.7708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6618    4.0424   -1.2606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2659   -1.3504    1.6249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2809   -0.4709    0.3108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3514   -0.7141   -1.1903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1853   -2.9438   -2.1372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8922   -5.3081   -2.0894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9970   -6.2417   -0.0745 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3816   -4.8062    1.9136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6698   -2.4423    1.8896 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9144   -1.3880    0.6601 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0997   -2.5330   -0.2400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2399   -0.9662   -3.8443 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1257   -1.2191   -5.4174 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4460   -1.3404   -4.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8947   -1.1934   -2.1551 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  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
  8 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  2  0
 18 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  2  0
 31 32  1  0
 32 33  2  0
 33 34  1  0
 34 35  2  0
 34  3  1  0
 17 11  1  0
 25 20  1  0
 33 28  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  2 39  1  0
  2 40  1  0
  4 41  1  0
  4 42  1  0
  5 43  1  0
  5 44  1  0
  6 45  1  0
  6 46  1  0
  7 47  1  0
  7 48  1  0
 12 49  1  0
 13 50  1  0
 16 51  1  0
 17 52  1  0
 18 53  1  0
 19 54  1  0
 19 55  1  0
 21 56  1  0
 22 57  1  0
 23 58  1  0
 24 59  1  0
 25 60  1  0
 26 61  1  0
 26 62  1  0
 29 63  1  0
 30 64  1  0
 31 65  1  0
 32 66  1  0
M  END
$$$$
