
     RDKit          3D

 71 74  0  0  0  0  0  0  0  0999 V2000
   -4.8626   -0.2295   -2.1358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5548    0.1153   -0.9617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9131    1.4805   -0.5463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0009    2.5317   -0.6601 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3771    3.7939   -0.3253 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6329    4.0543    0.1203 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5394    3.0493    0.2273 N   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2034    1.7725   -0.0938 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9038   -0.8296   -0.0704 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8789   -0.5574    1.3866 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4726   -0.6361    2.0191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5857    0.6033    1.7454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8168    0.5111    0.4068 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7374    0.6233    0.4500 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3559   -0.4716    1.3641 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8950   -0.3516    1.4700 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3855    1.0342    1.2569 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7356    1.2253    1.8222 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7484    0.4141    1.0671 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.0207    0.6874   -0.2811 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9591   -0.0943   -0.9607 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6125   -1.1308   -0.2942 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3127   -1.3786    1.0467 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3951   -0.6098    1.6918 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.4456    2.0304    1.7995 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1447    2.0403    0.9757 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2547    0.4184   -0.9843 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3656    0.8972   -1.3380 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5106   -0.2925   -1.9318 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5417   -1.7171   -2.0208 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5947   -2.2423   -2.9287 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4161   -1.7537   -4.2345 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0187   -1.8608   -2.4356 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1188   -0.4690   -2.2951 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3887   -2.5857   -1.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7683   -2.2356   -0.5202 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9994    2.3617   -1.0321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9155    5.0646    0.3805 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9410    0.9896    0.0034 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3038    0.4359    1.6344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5431   -1.2875    1.9014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9541   -1.5780    1.7425 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6206   -0.6911    3.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8901    0.7294    2.5980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2106    1.5227    1.7501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0702   -0.4392   -0.0662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1945    1.2999   -0.2724 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0835   -1.4888    1.0175 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9533   -0.3837    2.3926 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3454   -1.0066    0.6935 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2164   -0.7477    2.4596 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0396    2.2918    1.7360 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7535    0.9662    2.9050 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5078    1.4891   -0.7981 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1808    0.1036   -2.0024 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3376   -1.7426   -0.8128 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8129   -2.1785    1.5749 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2182    1.8047    2.8672 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8845    3.0521    1.7611 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3543    2.4792    1.6193 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2517    2.7469    0.1240 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4583   -2.1746   -1.0173 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5221   -2.0307   -2.4395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5302   -3.3555   -2.9543 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3714   -2.2173   -4.6150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7527   -2.2024   -3.2039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2287   -0.0904   -3.2003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3995   -3.6753   -1.3370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6169   -2.4731   -0.3388 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9287   -2.9141    0.3443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5648   -2.4968   -1.2496 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  1  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 17 25  1  0
 25 26  1  0
 14 27  1  0
 27 28  2  0
 27 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  1  0
 31 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
  8  3  1  0
 36  9  1  0
 26 14  1  0
 24 19  1  0
  4 37  1  0
  6 38  1  0
  8 39  1  0
 10 40  1  0
 10 41  1  0
 11 42  1  0
 11 43  1  0
 12 44  1  0
 12 45  1  0
 13 46  1  0
 13 47  1  0
 15 48  1  0
 15 49  1  0
 16 50  1  0
 16 51  1  0
 18 52  1  0
 18 53  1  0
 20 54  1  0
 21 55  1  0
 22 56  1  0
 23 57  1  0
 25 58  1  0
 25 59  1  0
 26 60  1  0
 26 61  1  0
 30 62  1  0
 30 63  1  0
 31 64  1  0
 32 65  1  0
 33 66  1  0
 34 67  1  0
 35 68  1  0
 35 69  1  0
 36 70  1  0
 36 71  1  0
M  END
$$$$
