
     RDKit          3D

 66 68  0  0  0  0  0  0  0  0999 V2000
    9.0323   -1.2850   -1.2568 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6097   -1.2962   -0.8138 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5664   -1.1389   -1.6558 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3798   -1.1091   -0.9894 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0779   -0.8877   -1.6996 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5535    0.4935   -1.4147 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3025    1.4896   -1.6128 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2302    0.6939   -0.8887 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0811   -0.0464   -1.4478 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0794    0.8919   -2.1562 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2158    1.1052   -1.3552 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1667   -0.1134   -1.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1474   -0.2361   -0.1838 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1155   -1.4410   -0.4620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5231   -1.2044    0.1069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1800   -0.0117   -0.4862 N   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0426   -0.3871   -1.6174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2366    1.0615   -0.8852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9874    1.0724    0.0025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3365   -0.5313    1.0778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7299   -1.6339    1.1781 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2282    0.4212    2.1060 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5539    0.1982    3.3495 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0296    0.0286    3.1810 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5603   -0.0759    4.4519 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6000    1.2000    2.3702 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8736    2.3119    3.1889 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8569    0.7593    1.5711 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0563    1.5797    0.2747 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4757   -1.2129    0.3960 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1043   -1.3523    0.7874 S   0  0  0  0  0  0  0  0  0  0  0  0
    9.6450   -1.9151   -0.5798 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4181   -0.2446   -1.2402 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1109   -1.6857   -2.2886 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3625   -1.6614   -1.3510 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2150   -1.0053   -2.7966 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4277   -0.7842   -2.2027 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5892   -0.6372   -0.6458 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5561    1.8790   -2.3446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1834    0.4755   -3.1537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7411    1.9820   -1.7906 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9650    1.3651   -0.3182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7455   -0.0461   -2.3471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5760   -1.0532   -1.4709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7202   -2.3959   -0.0554 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2324   -1.6120   -1.5548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4472   -1.0606    1.2057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1369   -2.1217   -0.0398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4768   -0.9776   -2.3701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4590    0.5169   -2.1104 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9005   -0.9901   -1.2529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7520    2.0418   -0.7862 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9188    0.9528   -1.9480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3970    1.9879   -0.1968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3425    1.1612    1.0533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7445    1.0713    4.0092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9819   -0.6972    3.8520 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1260   -0.9335    2.6449 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4784   -0.4279    4.3142 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1557    1.5397    1.6460 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6312    2.0783    3.7854 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7650    0.8417    2.2082 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7848   -0.3172    1.3115 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2177    2.2803    0.0776 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9501    2.2288    0.4063 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6522   -1.1795    1.0965 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 13 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 26 28  1  0
 28 29  1  0
  4 30  2  0
 30 31  1  0
 31  2  1  0
 29  8  1  0
 19 13  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  5 35  1  0
  5 36  1  0
  9 37  1  0
  9 38  1  0
 10 39  1  0
 10 40  1  0
 11 41  1  0
 11 42  1  0
 12 43  1  0
 12 44  1  0
 14 45  1  0
 14 46  1  0
 15 47  1  0
 15 48  1  0
 17 49  1  0
 17 50  1  0
 17 51  1  0
 18 52  1  0
 18 53  1  0
 19 54  1  0
 19 55  1  0
 23 56  1  0
 23 57  1  0
 24 58  1  0
 25 59  1  0
 26 60  1  0
 27 61  1  0
 28 62  1  0
 28 63  1  0
 29 64  1  0
 29 65  1  0
 30 66  1  0
M  END
$$$$
