
     RDKit          3D

 65 68  0  0  0  0  0  0  0  0999 V2000
    4.6107   -2.9096    0.2163 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5174   -1.6864    1.5091 S   0  0  0  0  0  6  0  0  0  0  0  0
    3.2368   -1.8612    2.2754 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6722   -1.9014    2.4459 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6265   -0.0735    0.8582 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5552    0.2222   -0.1121 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0448    1.3360   -1.0593 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1885    2.6979   -0.3503 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0500    2.9769    0.6494 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9252    2.0726    0.4060 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8256    2.5768   -0.3933 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0478    2.9724   -1.5696 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5467    2.7779    0.2101 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7242    2.5254   -0.7666 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7001    1.1150   -1.3750 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9684    0.6706   -1.8418 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0479    0.3748   -0.9994 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1531    1.2316   -1.0988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2791    1.0494   -0.3012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3216    0.0001    0.6086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2458   -0.8808    0.7117 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0953   -0.7422   -0.0986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9914   -1.7944    0.1157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2858   -2.3338   -1.1636 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7483   -2.2040   -1.2332 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0265   -2.3779    0.1137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8353   -2.2987    1.3993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0768   -1.4070    1.2919 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2434   -1.6253    0.2123 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0296   -0.2312    0.1005 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2069    0.6217    0.5895 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4161   -2.6360   -0.4958 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8350   -3.9008    0.6613 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6432   -2.9708   -0.3223 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5974    0.6021    1.6560 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4014   -0.6634   -0.7646 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3202    1.4374   -1.8970 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0211    1.0486   -1.5075 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1619    2.7345    0.1858 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2068    3.4974   -1.1225 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7279    4.0396    0.5778 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4192    2.8207    1.6864 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6097    3.8279    0.5664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6663    2.1342    1.1061 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6692    2.6674   -0.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7078    3.2791   -1.5833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9806    1.0922   -2.2201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3761    0.4123   -0.6249 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1284    2.0613   -1.7944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1176    1.7288   -0.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1932   -0.1349    1.2362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3176   -1.6852    1.4340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5172   -2.7033    0.4938 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7272   -1.8768   -2.0742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5161   -3.4198   -1.2581 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5085   -1.2756   -1.7653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3796   -2.9803   -1.9404 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3686   -3.4371    0.0953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1837   -3.3232    1.6618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2096   -1.9525    2.2506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8245   -0.3350    1.2931 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6554   -1.5345    2.2342 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8918    0.0367   -0.9634 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1971    0.0738    0.7457 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2933    0.4411    1.6828 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  2  0
  2  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  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  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 26 29  1  0
 29 30  1  0
 30 31  1  0
 31  6  1  0
 31 10  1  0
 22 17  1  0
 28 23  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  5 35  1  0
  6 36  1  0
  7 37  1  0
  7 38  1  0
  8 39  1  0
  8 40  1  0
  9 41  1  0
  9 42  1  0
 13 43  1  0
 13 44  1  0
 14 45  1  0
 14 46  1  0
 15 47  1  0
 15 48  1  0
 18 49  1  0
 19 50  1  0
 20 51  1  0
 21 52  1  0
 23 53  1  0
 24 54  1  0
 24 55  1  0
 25 56  1  0
 25 57  1  0
 26 58  1  0
 27 59  1  0
 27 60  1  0
 28 61  1  0
 28 62  1  0
 30 63  1  0
 30 64  1  0
 31 65  1  0
M  END
$$$$
