
     RDKit          3D

 68 71  0  0  0  0  0  0  0  0999 V2000
    3.9538   -2.4698    0.9542 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7220   -1.2881    0.4552 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0205   -1.1452    0.6034 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4367   -0.0335    0.0695 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.3616    0.5835   -0.4672 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4081    1.9550   -1.1025 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7694    2.2150   -1.7607 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0971    3.0252   -0.0534 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2284   -0.1789   -0.2112 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8249    0.1207   -0.5588 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5720    0.6777   -1.6614 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7406   -0.2245    0.3287 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8331    0.1570    1.7456 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0335   -0.7617    2.6844 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1656   -1.7949    1.9569 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5831   -1.2130    0.7298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3811   -2.4110    0.0969 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0563   -2.1119   -1.2676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5916   -2.1511   -1.1890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2739   -1.6672   -2.4822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9017   -0.2344   -2.9283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5304    0.6183   -1.8421 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3804    1.0950   -0.8314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7742    0.8863   -0.8621 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5799    1.3520    0.1797 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0098    2.0321    1.2582 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6360    2.2694    1.2855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8149    1.8040    0.2476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3844    2.1609    0.2484 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0599    3.3329   -0.0827 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3545    1.2353    0.6341 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6098   -0.0995    1.1961 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4982   -0.7216   -0.2919 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0827   -2.6670    0.2950 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6018   -2.2832    1.9887 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6083   -3.3662    0.9555 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6447    2.0168   -1.9058 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9978    1.4129   -2.4948 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5782    2.2467   -0.9988 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7560    3.1857   -2.3003 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1230    4.0343   -0.5167 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0783    2.8665    0.3650 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8380    2.9893    0.7779 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4850    1.2033    1.8627 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8934    0.1622    2.0780 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3986   -0.1386    3.3504 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7342   -1.3059    3.3535 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8281   -2.6218    1.6222 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5568   -2.2297    2.6811 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1298   -2.7863    0.8313 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6872   -3.2676   -0.0630 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7197   -1.1377   -1.6683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7336   -2.8811   -2.0096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9651   -1.5504   -0.3403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9116   -3.1977   -0.9962 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3731   -1.7249   -2.3288 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0293   -2.3728   -3.3075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0338   -0.2948   -3.6186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7316    0.2201   -3.5095 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2450    0.3742   -1.6881 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6498    1.1880    0.1514 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6368    2.3928    2.0648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2090    2.8211    2.1148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3911    1.6321    0.7231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6199    0.0015    2.3029 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6459   -0.4095    0.9693 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0929    0.0509   -0.9810 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7847   -1.5773   -0.9483 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  6  8  1  0
  5  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 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  1  0
 20 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  2  0
 29 31  1  0
 31 32  1  0
 16 33  1  0
  9  2  2  0
 33 12  1  0
 32 16  1  0
 28 23  1  0
  1 34  1  0
  1 35  1  0
  1 36  1  0
  6 37  1  0
  7 38  1  0
  7 39  1  0
  7 40  1  0
  8 41  1  0
  8 42  1  0
  8 43  1  0
 13 44  1  0
 13 45  1  0
 14 46  1  0
 14 47  1  0
 15 48  1  0
 15 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
 20 56  1  0
 20 57  1  0
 21 58  1  0
 21 59  1  0
 24 60  1  0
 25 61  1  0
 26 62  1  0
 27 63  1  0
 31 64  1  0
 32 65  1  0
 32 66  1  0
 33 67  1  0
 33 68  1  0
M  END
$$$$
