
     RDKit          3D

 67 70  0  0  0  0  0  0  0  0999 V2000
   -5.1044   -2.0352    1.4775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4100   -0.8218    0.9124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0851   -0.8242    0.6135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1870   -2.0290    0.8326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7731   -2.6385   -0.4830 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6441   -2.8100   -1.3790 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4258   -3.0694   -0.7347 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5936   -3.1668    0.3120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7993   -3.9392   -0.1837 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6140   -5.2937   -0.5160 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6683   -6.0588   -1.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4091   -7.7426   -1.4381 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.9246   -5.4814   -1.1957 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1331   -4.1421   -0.8639 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0878   -3.3573   -0.3423 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3806   -1.9152    0.0116 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7962   -1.0074   -0.9756 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2549    0.3415   -1.1360 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9702    0.9713   -2.1887 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0468    0.9623   -0.1677 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5216    1.3651    1.0961 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6264    1.9754    1.9548 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4395    2.2826    0.9188 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4985    3.4477    0.1402 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5996    3.8493   -0.3264 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2519    4.1808   -0.1675 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2841    5.4153   -0.8404 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0945    6.0646   -1.1820 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1379    5.4870   -0.8661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1877    4.2649   -0.1805 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0088    3.6207    0.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5005    3.5856    0.0821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7574    2.6209   -0.9943 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3348    1.4548   -0.4495 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7830    1.2411   -0.4857 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2228    0.4490    0.7461 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4877    0.3816   -0.0133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2400    0.4569   -0.1831 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6654   -2.3000    2.4625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0056   -2.8915    0.7772 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1867   -1.8469    1.6367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3027   -1.6829    1.4039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6546   -2.8199    1.4507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1900   -3.3697   -1.7088 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8525   -2.1467    0.6511 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1715   -3.7095    1.1856 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6400   -5.7530   -0.3937 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7431   -6.0697   -1.5911 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1183   -3.7169   -1.0119 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9906   -1.6907    1.0239 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4792   -1.7473    0.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1211   -1.3794   -1.6817 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1307    0.4811    1.6373 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1271    2.8133    1.4272 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2003    2.3495    2.9097 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3892    1.2018    2.1863 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2269    5.8718   -1.1127 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1273    7.0096   -1.7092 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0507    5.9871   -1.1648 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0347    2.6668    0.6812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4520    3.0866    1.0783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3251    4.3324    0.1377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4220    3.0475   -1.6824 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0455    0.6747   -1.4054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3182    2.2155   -0.5047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0806    1.0791    1.6508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3062    0.2213    0.6542 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 11 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  2  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
 24 25  2  0
 24 26  1  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  1  0
 34 37  1  0
 37 38  2  0
 36  2  1  0
 37  3  1  0
 15  9  1  0
 31 26  2  0
  1 39  1  0
  1 40  1  0
  1 41  1  0
  4 42  1  0
  4 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
 10 47  1  0
 13 48  1  0
 14 49  1  0
 16 50  1  0
 16 51  1  0
 17 52  1  0
 21 53  1  0
 22 54  1  0
 22 55  1  0
 22 56  1  0
 27 57  1  0
 28 58  1  0
 29 59  1  0
 31 60  1  0
 32 61  1  0
 32 62  1  0
 33 63  1  0
 35 64  1  0
 35 65  1  0
 36 66  1  0
 36 67  1  0
M  END
$$$$
