
     RDKit          3D

 78 80  0  0  0  0  0  0  0  0999 V2000
    4.2312   -5.6981   -1.2584 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2489   -4.8379   -0.1238 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2102   -3.4377   -0.2052 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2757   -2.7519   -1.4323 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2190   -1.3559   -1.4653 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1015   -0.6211   -0.2721 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0662    0.7810   -0.2558 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3432    1.6022   -1.3877 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3658    3.0738   -0.9727 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9636    3.6494   -0.7500 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2897    2.9782    0.3614 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9276    2.5314    0.2813 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3336    2.4941   -0.8331 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2031    2.0979    1.5323 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4719    0.6188    1.8744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1578   -0.3746    0.9371 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0795   -0.2045   -0.3109 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8029   -1.5435    1.4741 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4183   -2.6164    0.6830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3778   -3.7211    0.3230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0530   -4.9843   -0.2384 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7613   -3.2671   -0.6036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2413   -2.0471   -0.4570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9303   -2.2861   -1.6576 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3966   -1.2336   -0.1728 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3741   -1.7485    0.7933 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7651   -0.1613   -1.1138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3668    1.0760   -0.4150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4234    2.1525   -0.3338 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7965    3.4526    0.0460 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9727    4.0257   -0.4896 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3750    5.3094   -0.1313 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6233    6.0446    0.7760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4453    5.5133    1.3004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9972    4.2232    0.9357 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6772    3.7729    1.4793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9302    4.6317    2.0359 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2324    2.4047    1.4318 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0229   -1.3068    0.9446 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0828   -2.7034    0.9775 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3214   -5.5073   -1.8694 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1439   -5.5365   -1.8727 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2136   -6.7526   -0.9148 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3602   -3.2867   -2.3670 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2574   -0.8604   -2.4296 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3429    1.3361   -1.7964 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5805    1.4354   -2.1811 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9742    3.1967   -0.0515 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8581    3.6585   -1.7795 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0494    4.7300   -0.5095 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3813    3.5632   -1.6909 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7753    2.9488    1.2872 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6237    2.6772    2.3825 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0966    0.4418    2.9036 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5653    0.4321    1.8988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8592   -1.6349    2.5157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1393   -3.1242    1.3599 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1123   -4.0288    1.2784 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8923   -5.3023    0.4121 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3221   -5.8214   -0.2891 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4383   -4.8002   -1.2635 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2910   -2.3848   -0.1946 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5133   -4.0805   -0.6802 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4160   -3.0454   -1.6302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4871   -2.8504    0.6861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0339   -1.5116    1.8220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3805   -1.3104    0.6307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8796    0.1577   -1.7066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5022   -0.5696   -1.8387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2593    1.3789   -1.0039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7197    0.8518    0.6137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5636    3.5056   -1.2261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2745    5.7352   -0.5602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9457    7.0380    1.0611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8799    6.1275    1.9926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9315    1.6320    1.4586 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9285   -0.7548    1.8713 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0222   -3.2164    1.9284 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
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  2  0
 12 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  2  0
 16 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 20 22  1  0
 19 23  1  0
 23 24  2  0
 23 25  1  0
 25 26  1  0
 25 27  1  0
 27 28  1  0
 28 29  1  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
 35 36  1  0
 36 37  2  0
 36 38  1  0
  6 39  1  0
 39 40  2  0
 40  3  1  0
 38 14  1  0
 35 30  1  0
  1 41  1  0
  1 42  1  0
  1 43  1  0
  4 44  1  0
  5 45  1  0
  8 46  1  0
  8 47  1  0
  9 48  1  0
  9 49  1  0
 10 50  1  0
 10 51  1  0
 11 52  1  0
 14 53  1  0
 15 54  1  0
 15 55  1  0
 18 56  1  0
 19 57  1  0
 20 58  1  0
 21 59  1  0
 21 60  1  0
 21 61  1  0
 22 62  1  0
 22 63  1  0
 22 64  1  0
 26 65  1  0
 26 66  1  0
 26 67  1  0
 27 68  1  0
 27 69  1  0
 28 70  1  0
 28 71  1  0
 31 72  1  0
 32 73  1  0
 33 74  1  0
 34 75  1  0
 38 76  1  0
 39 77  1  0
 40 78  1  0
M  END
$$$$
