
     RDKit          3D

 69 72  0  0  0  0  0  0  0  0999 V2000
    9.4208    1.9729   -0.3943 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7796    0.6595   -0.6850 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6582    0.2206   -0.0816 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4989   -0.9834   -0.6715 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4191   -1.9518   -0.3048 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1540   -1.2517   -0.0979 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.3310   -0.8145   -1.1923 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7450   -0.9543   -2.3760 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0116   -0.1786   -0.9533 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4624    0.6821   -1.9185 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2263    1.2943   -1.7029 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5182    1.0629   -0.5201 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0563    0.2053    0.4654 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2890   -0.4253    0.2281 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3674   -0.0130    1.7917 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5935   -1.1761    1.7792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3269   -2.3332    2.5271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3120   -3.3138    2.6792 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5820   -3.1277    2.1238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8666   -1.9749    1.3778 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8378   -1.0474    1.1483 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2615   -1.7653    0.8253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4893   -0.3619    0.3911 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5622   -0.2820   -0.6360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9887   -0.1727   -2.0687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1096    1.0701   -2.2388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2252   -1.4285   -2.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7795    0.5114    1.5589 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3117    1.9515    1.3047 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9011    1.9718    1.2143 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4455    3.0991    0.4947 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9560    2.9258    0.2021 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7444    1.6367   -0.3632 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4764   -1.2613   -1.5566 N   0  0  0  0  0  0  0  0  0  0  0  0
    9.2461   -0.2164   -1.5403 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.6748    2.7859   -0.5136 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8049    1.9762    0.6472 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.2646    2.1480   -1.0944 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3031   -2.7232   -1.0960 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7128   -2.4681    0.6341 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9030   -0.9942    0.8822 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9922    0.8872   -2.8404 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8115    1.9450   -2.4624 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6736   -1.1122    0.9701 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1334   -0.1581    2.5850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1847    0.8997    2.0950 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6284   -2.4621    3.0212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1039   -4.2005    3.2644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3473   -3.8763    2.2878 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0224   -0.1980    0.5198 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0170   -2.0582    1.5897 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3798   -2.4732   -0.0197 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2099    0.6101   -0.4807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2535   -1.1534   -0.5747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8546   -0.0633   -2.7593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6816    1.9847   -1.9754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7827    1.1652   -3.2961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2042    0.9986   -1.5992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8587   -2.3304   -2.3673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2826   -1.5429   -1.9239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9638   -1.3568   -3.5804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8655    0.5017    1.8064 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2472    0.1522    2.4691 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6235    2.5832    2.1659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8205    2.3401    0.3948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5995    4.0236    1.0936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9685    3.2046   -0.4813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6137    3.7086   -0.5088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3837    3.0262    1.1492 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  1  0
  7  8  2  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
 15 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 25 27  1  0
 23 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
  4 34  2  0
 34 35  1  0
 35  2  1  0
 14  9  1  0
 21 16  1  0
 33 12  1  0
  1 36  1  0
  1 37  1  0
  1 38  1  0
  5 39  1  0
  5 40  1  0
  6 41  1  0
 10 42  1  0
 11 43  1  0
 14 44  1  0
 15 45  1  0
 15 46  1  0
 17 47  1  0
 18 48  1  0
 19 49  1  0
 21 50  1  0
 22 51  1  0
 22 52  1  0
 24 53  1  0
 24 54  1  0
 25 55  1  0
 26 56  1  0
 26 57  1  0
 26 58  1  0
 27 59  1  0
 27 60  1  0
 27 61  1  0
 28 62  1  0
 28 63  1  0
 29 64  1  0
 29 65  1  0
 31 66  1  0
 31 67  1  0
 32 68  1  0
 32 69  1  0
M  END
$$$$
