
     RDKit          3D

 57 60  0  0  0  0  0  0  0  0999 V2000
    4.8993   -1.7919   -1.9056 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6268   -0.7602   -1.2332 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6911    0.2375   -1.0040 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9839   -0.0754   -1.2945 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.9820    0.8290   -1.1177 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6874    2.1040   -0.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3588    2.4150   -0.3540 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3896    1.4829   -0.5451 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2876   -0.5781   -0.7312 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1619   -1.1718   -1.4657 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8590   -0.4399   -1.1266 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5285   -0.4792    0.4061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3463   -1.7355    0.7259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7252   -1.7731    0.0159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8346   -2.2445    0.9714 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2520   -2.1450    0.3753 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5907   -0.7983   -0.2403 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0014   -0.7488   -1.5852 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3319    0.4675   -2.1840 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2643    1.6495   -1.4491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8608    1.6214   -0.1138 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5126    0.4039    0.5027 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0815    0.3599    1.8380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4748    1.4419    2.5492 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1633    1.8759    1.8886 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3587    0.7350    1.6034 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2030    0.7985    0.8136 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2629    1.9235    0.4795 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8347   -0.5726    1.2623 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0487    0.0606    0.5724 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0027    0.5583   -1.3520 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4711    2.8361   -0.4928 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0965    3.3974    0.0145 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0762   -2.2497   -1.2099 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3379   -1.0849   -2.5606 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9807    0.6074   -1.4795 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0386   -0.8684   -1.7387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4772   -1.7911    1.8303 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2090   -2.6572    0.4430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6771   -2.4657   -0.8526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9802   -0.7725   -0.3875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7905   -1.6703    1.9186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6424   -3.3056    1.2423 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9901   -2.3589    1.1779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3629   -2.9547   -0.3790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0661   -1.6544   -2.1754 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6455    0.4925   -3.2197 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5276    2.5905   -1.9145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8290    2.5522    0.4342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1752    2.2997    2.6281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2538    1.0949    3.5804 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3859    2.4200    0.9459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6128    2.5612    2.5681 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6927   -0.1039    2.2618 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0972   -1.6368    1.4575 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9320   -0.0769    1.2343 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8806    1.1491    0.4297 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  2  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
 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  2  0
 12 29  1  0
 29 30  1  0
  8  3  1  0
 30  9  1  0
 27 12  1  0
 22 17  1  0
  5 31  1  0
  6 32  1  0
  7 33  1  0
 10 34  1  0
 10 35  1  0
 11 36  1  0
 11 37  1  0
 13 38  1  0
 13 39  1  0
 14 40  1  0
 14 41  1  0
 15 42  1  0
 15 43  1  0
 16 44  1  0
 16 45  1  0
 18 46  1  0
 19 47  1  0
 20 48  1  0
 21 49  1  0
 24 50  1  0
 24 51  1  0
 25 52  1  0
 25 53  1  0
 29 54  1  0
 29 55  1  0
 30 56  1  0
 30 57  1  0
M  END
$$$$
