
     RDKit          3D

 83 86  0  0  0  0  0  0  0  0999 V2000
    9.7875    0.0777    2.8528 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8232   -1.0878    2.0339 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8338   -1.4311    1.1002 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0005   -2.6045    0.3607 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.0534   -2.9838   -0.5915 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9120   -2.1984   -0.8162 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9084   -2.6278   -1.8514 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7288   -1.0116   -0.0726 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6010   -0.1575   -0.3334 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8345    0.4858    0.6954 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0088    0.1905    1.9090 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7832    1.4863    0.3192 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7137    0.8381   -0.4691 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9004   -0.0747    0.3744 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5458   -0.3883   -0.2723 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3375    0.8913   -0.3990 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1907    1.0594    0.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2103    2.1708    0.8026 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3606    2.1191    1.4890 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3891    3.2042    1.3637 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9809    3.2012    0.0239 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1847    2.4888   -0.3018 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8197    2.7904   -1.3473 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6963    1.4105    0.5622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8091    1.6524    1.3808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2669    0.6637    2.2550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6094   -0.5659    2.3229 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5067   -0.8209    1.5025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0490    0.1609    0.6025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9738   -0.0706   -0.2695 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0786   -1.1779   -0.1806 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9751   -1.0830   -1.2611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3445   -1.7668   -2.6107 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6997   -1.3088   -3.1773 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2984   -3.3001   -2.5085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6059    0.3170   -1.4974 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2407    0.7277   -1.6221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7875    0.9627   -2.7740 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5694    2.1561   -0.5710 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9120    1.8240   -1.2411 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6946   -0.6351    0.8776 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7703    0.9909    2.2195 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8932    0.0536    3.5101 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6961    0.1031    3.4886 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.8744   -3.2237    0.5197 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2135   -3.8935   -1.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8846   -2.5972   -1.4241 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1009   -3.6641   -2.2004 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9629   -1.9470   -2.7255 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2818   -0.0393   -1.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3670    1.9834    1.2233 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2969    2.2689   -0.2805 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7236    0.3571    1.3848 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4546   -1.0274    0.5091 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0326   -1.1782    0.3194 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7488   -0.8297   -1.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7106    0.1056    1.1277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5316    1.2650    1.7703 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0168    3.0209    0.1526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5653    1.2804    2.1487 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9083    4.1891    1.5564 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1783    3.0675    2.1352 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5740    3.8440   -0.6940 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3132    2.6110    1.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1264    0.8543    2.8868 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9661   -1.3307    3.0022 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0261   -1.7866    1.5699 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6409   -2.1303   -0.2762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6082   -1.1723    0.8256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0857   -1.6136   -0.8534 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5642   -1.4773   -3.3513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5376   -1.6143   -2.5151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7249   -0.2065   -3.3049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8638   -1.7679   -4.1752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3129   -3.6327   -2.1224 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4393   -3.7500   -3.5141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0949   -3.6866   -1.8390 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3217    0.9657   -1.8932 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8041    2.6141    0.4155 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0499    2.9414   -1.1631 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4673    2.7716   -1.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7239    1.4035   -2.2515 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5683    0.2936    1.4151 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
  6  8  1  0
  8  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  2  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  2  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 33 35  1  0
 32 36  1  0
 36 37  1  0
 37 38  2  0
 16 39  1  0
 39 40  1  0
  8 41  2  0
 41  3  1  0
 40 13  1  0
 37 16  1  0
 29 24  1  0
  1 42  1  0
  1 43  1  0
  1 44  1  0
  4 45  1  0
  5 46  1  0
  7 47  1  0
  7 48  1  0
  7 49  1  0
  9 50  1  0
 12 51  1  0
 12 52  1  0
 14 53  1  0
 14 54  1  0
 15 55  1  0
 15 56  1  0
 17 57  1  0
 17 58  1  0
 18 59  1  0
 19 60  1  0
 20 61  1  0
 20 62  1  0
 21 63  1  0
 25 64  1  0
 26 65  1  0
 27 66  1  0
 28 67  1  0
 31 68  1  0
 31 69  1  0
 32 70  1  0
 33 71  1  0
 34 72  1  0
 34 73  1  0
 34 74  1  0
 35 75  1  0
 35 76  1  0
 35 77  1  0
 36 78  1  0
 39 79  1  0
 39 80  1  0
 40 81  1  0
 40 82  1  0
 41 83  1  0
M  END
$$$$
