
     RDKit          3D

 67 71  0  0  0  0  0  0  0  0999 V2000
    4.9038    1.5708   -3.5541 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9758    0.8045   -2.2985 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.2817    1.2403   -1.1922 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5836    2.2881   -1.2367 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3957    0.5121   -0.0109 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2235   -0.5592    0.0474 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2964   -1.0403    1.3020 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.4647   -0.2183    1.9895 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8806    0.7315    1.2155 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.9936    1.8040    1.6802 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6047    1.6744    1.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2715    2.5010    0.2044 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6463    0.6690    1.5249 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9660   -0.3375    2.5491 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7832   -1.7657    2.0031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2666   -1.8735    0.8788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3485   -0.7889    0.9712 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1524   -0.9808    2.1917 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2921   -1.8559    2.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6165   -2.3635    3.3660 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1609   -2.0992    1.0655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7407   -0.8552    0.6898 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1730   -0.5143   -0.5979 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3801   -1.4942   -1.5875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7919   -1.1267   -2.8693 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0066    0.2156   -3.1769 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8146    1.1973   -2.2025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3929    0.8489   -0.9072 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2787    1.9382    0.1444 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0531    1.8108    1.0136 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8151    1.9156    0.5109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5894    1.7686    1.3774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6845    0.6218    0.8722 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9343   -0.9932   -1.0291 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.8654   -2.1242   -0.9141 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8175   -0.2907   -2.2078 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5005   -0.6430   -3.2111 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9105    2.0562   -3.6728 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0338    0.9083   -4.4364 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6966    2.3487   -3.5601 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3112   -0.3020    3.0569 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9344    1.8093    2.7896 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4335    2.7849    1.3954 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3163   -0.1741    3.4311 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9888   -0.2370    2.9415 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4935   -2.4348    2.8421 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7570   -2.1308    1.6102 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2458   -1.7748   -0.1044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7365   -2.8809    0.9016 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0044   -0.8886    0.0809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7718   -0.6585    3.1066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5410   -2.5212    0.2466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9676   -2.8235    1.3070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2395   -2.5442   -1.3683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9592   -1.8839   -3.6258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3335    0.4971   -4.1705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0107    2.2316   -2.4579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2542    2.9409   -0.3356 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1815    1.9019    0.7885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1910    1.6297    2.0775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6811    2.1074   -0.5501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8558    1.6112    2.4443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0378    2.7305    1.3288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5174    0.7859   -0.2169 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7913   -2.7815   -1.8082 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9042   -1.7415   -0.8221 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6350   -2.7544   -0.0282 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  2  0
 19 21  1  0
 21 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
 31 32  1  0
 32 33  1  0
  6 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  2  0
 36  2  1  0
  9  5  1  0
 33 13  1  0
 33 17  1  0
 28 23  1  0
  1 38  1  0
  1 39  1  0
  1 40  1  0
  8 41  1  0
 10 42  1  0
 10 43  1  0
 14 44  1  0
 14 45  1  0
 15 46  1  0
 15 47  1  0
 16 48  1  0
 16 49  1  0
 17 50  1  0
 18 51  1  0
 21 52  1  0
 21 53  1  0
 24 54  1  0
 25 55  1  0
 26 56  1  0
 27 57  1  0
 29 58  1  0
 29 59  1  0
 30 60  1  0
 31 61  1  0
 32 62  1  0
 32 63  1  0
 33 64  1  0
 35 65  1  0
 35 66  1  0
 35 67  1  0
M  END
$$$$
