
     RDKit          3D

 72 75  0  0  0  0  0  0  0  0999 V2000
   -2.6428    4.8596    0.1980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7890    4.1092   -0.4989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2289    4.8871   -1.7473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4001    2.6591   -0.8875 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2345    1.7093    0.3275 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4039    0.2253   -0.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1528   -0.5835    1.0958 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1731   -1.9885    1.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0579   -2.5030    2.4930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0548   -3.8780    2.7304 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1575   -4.7701    1.6649 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1600   -6.5023    1.9622 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -3.2584   -4.2863    0.3596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2760   -2.9033    0.1015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3411   -2.5113   -1.3154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4161   -2.0484   -1.7798 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2715   -2.8407   -2.2110 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9559   -2.2042   -2.1221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0984   -2.8064   -1.0009 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1199   -1.9244   -0.6769 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7545   -0.6617    0.1481 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9378    0.5855   -0.6208 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2042    0.8806   -1.2422 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2312    1.3826   -2.3969 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4746    0.5503   -0.5740 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4775   -0.1525   -1.2548 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6712   -0.4721   -0.6060 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8647   -0.0661    0.7284 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0922   -0.3463    1.4286 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.0998   -1.1587    1.0543 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0690   -1.1072    2.0311 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6759   -0.2756    3.0196 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.4653    0.1647    2.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8807    0.6388    1.3588 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.7025    0.9393    0.7532 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1780    1.5348   -0.7617 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6290    2.0203    0.5928 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2470    2.5131    1.3561 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9866    1.9416    1.0788 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4843    4.4615    1.2207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6992    4.7746   -0.3828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8946    5.9363    0.3091 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6570    4.0777    0.1962 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3982    4.9518   -2.4826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5406    5.9168   -1.4677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0991    4.3860   -2.2262 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4947    2.6812   -1.5202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2135    2.2471   -1.5276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0826    1.9245    1.0193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7250   -0.0463   -0.8636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4505    0.0630   -0.3814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9713   -1.8249    3.3348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9669   -4.2469    3.7434 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3291   -4.9927   -0.4612 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5255   -3.2822   -3.1254 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4214   -2.3441   -3.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0852   -1.1178   -1.9833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6822   -2.9576   -0.0715 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2555   -3.8086   -1.3295 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6494   -1.6688   -1.6214 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8298   -2.5347   -0.0731 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3960   -0.6228    1.0543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2901   -0.7290    0.5277 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3295   -0.4681   -2.2826 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4310   -1.0212   -1.1466 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1432   -1.7419    0.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0035   -1.6474    2.0267 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8717    0.8655    3.1988 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9538    1.4994    1.3017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9801    1.0631   -1.3423 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1374    2.4271   -1.3471 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1117    2.1691    2.0911 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  1  0
  8  9  2  0
  9 10  1  0
 10 11  2  0
 11 12  1  0
 11 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 15 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 23 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  2  0
 31 32  1  0
 32 33  2  0
 28 34  1  0
 34 35  2  0
 22 36  1  0
 36 37  1  0
 37 38  2  0
 37 39  1  0
 39  5  1  0
 14  8  1  0
 35 25  1  0
 33 29  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  3 44  1  0
  3 45  1  0
  3 46  1  0
  4 47  1  0
  4 48  1  0
  5 49  1  0
  6 50  1  0
  6 51  1  0
  9 52  1  0
 10 53  1  0
 13 54  1  0
 17 55  1  0
 18 56  1  0
 18 57  1  0
 19 58  1  0
 19 59  1  0
 20 60  1  0
 20 61  1  0
 21 62  1  0
 21 63  1  0
 26 64  1  0
 27 65  1  0
 30 66  1  0
 31 67  1  0
 33 68  1  0
 35 69  1  0
 36 70  1  0
 36 71  1  0
 39 72  1  0
M  END
$$$$
