
     RDKit          3D

 61 64  0  0  0  0  0  0  0  0999 V2000
   -2.4195    0.3655    3.4174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2957   -0.0752    1.9585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3120   -1.1842    1.6192 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6180   -0.6852    1.3193 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9518    0.4051    0.4954 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8360    1.3400    1.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2557    2.4560    0.3314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8089    2.6496   -0.9716 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9455    1.7253   -1.5576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5011    0.5909   -0.8477 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5902   -0.3654   -1.5901 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1976    0.2605   -1.7988 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1374   -0.7369   -2.3013 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4143   -1.5660   -1.2057 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6414   -0.8328   -0.3014 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4658   -1.9152    0.4834 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7988   -2.2693   -0.1854 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6251   -1.0633   -0.3326 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.0469   -1.2042   -0.5106 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5018   -2.2323   -1.0816 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.9936   -0.1757   -0.0431 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7844    0.7470    0.9811 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8448    1.5562    1.2452 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.8934    1.2761    0.4434 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1341    1.9730    0.5097 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.5668    0.0147   -0.6171 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.9715    0.2372   -0.5463 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5975    0.0330   -1.1923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0842    0.0281    0.7327 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0466    1.2834    0.7355 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9456   -0.5809    1.7052 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4445    0.7457    3.6151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6943    1.1807    3.6259 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2074   -0.4827    4.1033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4852    0.8164    1.3256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9441   -1.8257    0.8060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4031   -1.8777    2.4825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1949    1.2021    2.0655 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9318    3.1702    0.7833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1389    3.5138   -1.5335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6271    1.8914   -2.5795 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0323   -0.5666   -2.5909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5412   -1.3556   -1.1168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8625    0.7782   -0.8892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2980    1.0557   -2.5696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6277   -1.4454   -3.0047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3947   -0.1887   -2.9155 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1696   -2.0785   -0.5780 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1175   -2.3811   -1.7451 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7188   -1.5463    1.5037 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8737   -2.8459    0.6284 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6186   -2.7246   -1.1832 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3271   -3.0138    0.4497 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8724    0.8073    1.5566 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2666    2.7497    1.1945 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.9236    1.7047   -0.1188 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8520    0.7635    0.4231 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5870    0.8714   -1.2214 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7779   -0.4815   -2.1626 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1489    1.0191   -1.4409 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6859   -1.5106    2.1045 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  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  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
 19 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 24 26  1  0
 18 27  1  0
 27 28  1  0
 15 29  1  0
 29 30  2  0
 29 31  1  0
 31  2  1  0
 10  5  1  0
 28 15  1  0
 26 21  1  0
  1 32  1  0
  1 33  1  0
  1 34  1  0
  2 35  1  0
  3 36  1  0
  3 37  1  0
  6 38  1  0
  7 39  1  0
  8 40  1  0
  9 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
 14 48  1  0
 14 49  1  0
 16 50  1  0
 16 51  1  0
 17 52  1  0
 17 53  1  0
 22 54  1  0
 25 55  1  0
 25 56  1  0
 27 57  1  0
 27 58  1  0
 28 59  1  0
 28 60  1  0
 31 61  1  0
M  END
$$$$
