
     RDKit          3D

 72 73  0  0  0  0  0  0  0  0999 V2000
    6.1849   -2.4193    1.0125 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3062   -1.7132   -0.0304 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1752   -0.7840   -0.8892 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1563   -0.9590    0.6870 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0495   -0.3383   -0.2038 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6261   -1.2612   -1.2691 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4374   -2.0718   -1.2261 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4352   -3.1682   -1.8490 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2081   -1.6608   -0.4400 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.2416   -2.3158    0.9432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0259   -2.0381   -1.1476 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2935   -1.3630   -1.0247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2046   -1.6438   -1.8502 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5956   -0.3564    0.0755 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.4123   -1.0226    1.2082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7994   -1.4462    0.7843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0400   -2.7648    0.3604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3214   -3.1536   -0.0417 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3713   -2.2318   -0.0228 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1422   -0.9194    0.3993 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8625   -0.5263    0.8028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3179    0.8177   -0.4532 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5665    1.5258   -1.5133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5992    3.0581   -1.3323 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5454    3.5444   -0.3209 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1661    3.7176   -0.9829 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9710    3.8784    0.0367 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2241    2.5854    0.8401 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7002    2.4144    1.2289 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5313    2.1832    0.0456 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4529    1.0065   -0.7758 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7559    1.1034   -1.9958 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6575   -1.6791    1.6937 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5767   -3.1267    1.6163 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9849   -3.0047    0.5103 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8820   -2.5070   -0.6824 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1016   -1.3041   -1.2124 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4592    0.1281   -0.3222 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6374   -0.4967   -1.8123 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6530   -1.6841    1.3641 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5851   -0.1721    1.3465 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2020   -0.1521    0.4764 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3032   -1.4638   -2.0392 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2315   -0.5595   -0.3454 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2144   -2.1317    1.4441 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0898   -3.4129    0.8547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5508   -1.8949    1.5911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0013   -2.8500   -1.8057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6581    0.0053    0.5435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8610   -1.9047    1.5987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4939   -0.3129    2.0605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2348   -3.4890    0.3371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5006   -4.1695   -0.3695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3623   -2.5344   -0.3344 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9567   -0.2067    0.4143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7016    0.4928    1.1316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4979    1.4629    0.3522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5113    1.1800   -1.5840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0453    1.2833   -2.4861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6115    3.3715   -0.9963 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4268    3.5487   -2.3157 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8651    4.5274    0.0885 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4917    2.8342    0.5314 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0681    2.8573   -1.6461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1945    4.6237   -1.6270 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8827    4.1639   -0.5306 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7426    4.7158    0.7317 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6131    2.6101    1.7679 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8944    1.6999    0.2599 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0479    3.3323    1.7508 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8132    1.5711    1.9426 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1326    2.9709   -0.2857 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  7  9  1  0
  9 10  1  0
  9 11  1  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
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 14 22  1  0
 22 23  1  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
 30 31  1  0
 31 32  2  0
 31  5  1  0
 21 16  1  0
  1 33  1  0
  1 34  1  0
  1 35  1  0
  2 36  1  0
  3 37  1  0
  3 38  1  0
  3 39  1  0
  4 40  1  0
  4 41  1  0
  5 42  1  1
  6 43  1  0
  9 44  1  1
 10 45  1  0
 10 46  1  0
 10 47  1  0
 11 48  1  0
 14 49  1  1
 15 50  1  0
 15 51  1  0
 17 52  1  0
 18 53  1  0
 19 54  1  0
 20 55  1  0
 21 56  1  0
 22 57  1  0
 23 58  1  0
 23 59  1  0
 24 60  1  0
 24 61  1  0
 25 62  1  0
 25 63  1  0
 26 64  1  0
 26 65  1  0
 27 66  1  0
 27 67  1  0
 28 68  1  0
 28 69  1  0
 29 70  1  0
 29 71  1  0
 30 72  1  0
M  END
$$$$
