
     RDKit          3D

 76 80  0  0  0  0  0  0  0  0999 V2000
   -4.9653   -2.8801   -0.3247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6360   -2.2682   -0.4012 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1774   -1.7722   -1.7088 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9116   -0.4901   -2.1489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6075    0.0950   -1.0505 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9933    1.4379   -0.9402 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8378    2.3512   -2.0015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1963    3.6917   -1.8355 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7201    4.1336   -0.6211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8925    3.2346    0.4337 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5445    1.8815    0.2808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7722    0.9238    1.4279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6238    0.9493    2.4630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7681   -0.3334    2.4705 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5551   -0.2451    1.5244 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8079   -1.5960    1.3432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5123   -1.3224    0.5021 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6007   -0.9240    1.3730 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5743    0.0521    0.9583 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2152    0.6993    1.8298 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8349    0.3318   -0.4970 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1978    0.7028   -0.7064 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2950   -0.1621   -0.5648 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1645   -1.5369   -0.2561 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3099   -2.3463   -0.1204 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5907   -1.7973   -0.2921 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6941   -0.4405   -0.5975 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5845    0.3444   -0.7296 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9214    1.6463   -1.0311 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3415    1.7910   -1.1198 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8091    2.8143   -0.0766 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7124    2.2586   -2.5336 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9218    0.3678   -0.8218 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8146   -1.6523    2.6237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2808   -2.6972    2.8099 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5468   -2.0882    2.6642 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6789   -2.6252    0.6181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5535   -3.8422    0.9248 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3684   -2.7957    0.7065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9004   -3.9536   -0.6024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6742   -2.3771   -1.0163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3258   -2.5655   -2.4742 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0883   -1.5752   -1.6919 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1552    0.2171   -2.5524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6435   -0.7265   -2.9506 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4477    2.0376   -2.9590 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0652    4.3895   -2.6513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9932    5.1739   -0.4950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3054    3.5909    1.3700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7165    1.2133    1.9422 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9615   -0.1024    1.0457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0844    1.0452    3.4707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9796    1.8478    2.3371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3932   -1.2208    2.2419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3847   -0.4814    3.5040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8470    0.4959    1.9573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8547    0.1609    0.5444 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7059   -0.5307   -0.2538 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2074   -2.2390   -0.0513 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5896   -0.5512   -1.1259 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1830    1.1716   -0.8169 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1922   -1.9886   -0.1187 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2028   -3.3967    0.1175 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4754   -2.4125   -0.1905 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5090    2.4874    0.9424 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3452    3.8045   -0.2747 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9143    2.9237   -0.1075 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8143    2.3659   -2.6316 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3566    1.5223   -3.2871 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2350    3.2379   -2.7539 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4944   -0.0501   -1.6788 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5580    0.3469    0.0902 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8065   -2.1544    2.6047 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7845   -0.9380    3.4748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2054   -3.1227    3.8319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1543   -3.5369    2.0899 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  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  2  0
 19 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  1  0
 30 31  1  0
 30 32  1  0
 30 33  1  0
 18 34  1  0
 34 35  1  0
 35 36  1  0
 16 37  1  0
 37 38  2  0
 37  2  1  0
 11  6  1  0
 36 16  1  0
 28 23  1  0
 33 27  1  0
  1 39  1  0
  1 40  1  0
  1 41  1  0
  3 42  1  0
  3 43  1  0
  4 44  1  0
  4 45  1  0
  7 46  1  0
  8 47  1  0
  9 48  1  0
 10 49  1  0
 12 50  1  0
 12 51  1  0
 13 52  1  0
 13 53  1  0
 14 54  1  0
 14 55  1  0
 15 56  1  0
 15 57  1  0
 17 58  1  0
 17 59  1  0
 21 60  1  0
 21 61  1  0
 24 62  1  0
 25 63  1  0
 26 64  1  0
 31 65  1  0
 31 66  1  0
 31 67  1  0
 32 68  1  0
 32 69  1  0
 32 70  1  0
 33 71  1  0
 33 72  1  0
 34 73  1  0
 34 74  1  0
 35 75  1  0
 35 76  1  0
M  END
$$$$
