
     RDKit          3D

 80 83  0  0  0  0  0  0  0  0999 V2000
   -7.3185    1.9052   -0.0294 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9732    2.1950    0.4822 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9149    2.5536   -0.4759 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5068    1.3572   -1.3389 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1618    0.2426   -0.5192 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9394   -1.0344   -1.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7836   -2.0759   -0.6449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6314   -3.3577   -1.1785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6320   -3.6101   -2.1208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7704   -2.5847   -2.5171 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9009   -1.2976   -1.9727 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9082   -0.2685   -2.3309 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7424    0.0333   -3.5426 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1274    0.3939   -1.3264 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6767   -0.2970   -0.1110 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5256   -1.1514   -0.4129 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2761   -0.8717   -1.3886 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8402   -2.2571    0.4459 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9431   -3.1769    0.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2766   -2.4795    0.2747 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2707   -2.7213   -0.6855 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5255   -2.1168   -0.5729 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8041   -1.2504    0.4961 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1690   -0.6059    0.6244 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3064    0.6705   -0.1111 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.1475    0.5361   -1.5682 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4937    1.8767   -2.2530 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7126    2.9188   -1.3157 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6037    3.0226   -0.4415 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4470    1.7482    0.4141 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8158   -1.0223    1.4672 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5661   -1.6402    1.3638 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3378    0.7181    0.9996 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5904    1.4065    1.5719 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4911    0.4645    2.3385 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9827   -0.5448    2.9029 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9094    0.7100    2.4734 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7467   -0.4069    2.9314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4255    2.0874    2.5723 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7788    2.2363    1.9155 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7839    2.3508    2.6698 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3591    1.9813   -1.1362 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6161    0.8758    0.2652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0479    2.6337    0.3854 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0256    2.9709    0.0282 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2877    3.3623   -1.1409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6481    1.6583   -1.9723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3472    1.0765   -2.0094 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5770   -1.8829    0.0668 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2955   -4.1536   -0.8695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5170   -4.6052   -2.5332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9808   -2.8018   -3.2264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6197    1.2613   -1.6157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4780   -0.9723    0.2561 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2392   -2.4363    1.2828 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9224   -4.0050    0.9143 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8013   -3.6228   -0.8343 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0788   -3.3859   -1.5185 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2813   -2.3284   -1.3175 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4019   -0.4335    1.6984 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9467   -1.3168    0.2669 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0984    0.2654   -1.8226 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8208   -0.2618   -1.9536 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6913    2.1674   -2.9684 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4242    1.7475   -2.8458 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6709    3.2214   -1.0169 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7596    3.8963    0.2263 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7399    1.9713    1.4636 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3777    1.4450    0.4067 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0162   -0.3717    2.3094 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8239   -1.4638    2.1327 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3430    1.4978    0.5915 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2116    0.2154    1.8274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2658    2.2167    2.2591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1492    1.8666    0.7335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8262   -0.1487    2.9247 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4614   -0.6885    3.9673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6011   -1.2836    2.2652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7178    2.8311    2.1619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5178    2.3442    3.6509 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  1  0
  5  6  1  0
  6  7  2  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  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  2  0
 21 22  1  0
 22 23  2  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 23 31  1  0
 31 32  2  0
 15 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  2  0
 35 37  1  0
 37 38  1  0
 37 39  1  0
 39 40  1  0
 40 41  2  0
 40  2  1  0
 11  6  1  0
 32 20  1  0
 30 25  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  3 45  1  0
  3 46  1  0
  4 47  1  0
  4 48  1  0
  7 49  1  0
  8 50  1  0
  9 51  1  0
 10 52  1  0
 14 53  1  0
 15 54  1  0
 18 55  1  0
 19 56  1  0
 19 57  1  0
 21 58  1  0
 22 59  1  0
 24 60  1  0
 24 61  1  0
 26 62  1  0
 26 63  1  0
 27 64  1  0
 27 65  1  0
 29 66  1  0
 29 67  1  0
 30 68  1  0
 30 69  1  0
 31 70  1  0
 32 71  1  0
 33 72  1  0
 33 73  1  0
 34 74  1  0
 34 75  1  0
 38 76  1  0
 38 77  1  0
 38 78  1  0
 39 79  1  0
 39 80  1  0
M  END
$$$$
