
     RDKit          3D

 70 73  0  0  0  0  0  0  0  0999 V2000
    1.9479    2.1301   -1.2084 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5592    0.9880   -1.5767 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5398    0.0362   -2.1930 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8647   -1.0594   -1.2679 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.0689   -0.9930   -0.4788 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8211   -2.0040   -0.4077 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3870    0.2107    0.3259 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3652    0.7599    1.1202 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6148    1.8495    1.9519 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8929    2.3952    2.0211 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9246    1.8619    1.2470 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6896    0.7806    0.3725 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8358    0.2318   -0.4577 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8839    1.1328   -0.5276 F   0  0  0  0  0  0  0  0  0  0  0  0
    7.3046   -0.9352    0.1169 F   0  0  0  0  0  0  0  0  0  0  0  0
    6.4159   -0.0268   -1.7496 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.0718   -2.3002   -1.2818 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6860   -2.7244    0.1452 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6495   -3.8668    0.1659 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7933   -3.3473    0.2451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0631   -2.7260    1.5464 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3274   -2.1439    1.8986 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5041   -1.7213    3.0734 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4520   -2.0788    0.9490 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5922   -2.8440    1.2473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6735   -2.8871    0.3647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0846   -3.8551    0.7521 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -5.6253   -2.1678   -0.8289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5064   -1.3902   -1.1318 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4238   -1.3094   -0.2450 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3684   -0.4626   -0.6153 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5668    0.3216    0.2674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7386    1.3297   -0.5412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6144    2.2700   -1.3941 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5308    3.1115   -0.5398 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0278    4.2324    0.1436 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8650    4.9863    0.9720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2057    4.6234    1.1298 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7123    3.5063    0.4607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8801    2.7528   -0.3749 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1898    0.6011   -1.4098 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4663    0.5830   -2.4765 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1153   -0.3678   -3.1362 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3707    0.3331    1.1120 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8173    2.2650    2.5561 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0873    3.2305    2.6807 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9086    2.3056    1.3345 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1508   -2.1630   -1.8880 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6678   -3.1092   -1.7597 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6003   -3.0764    0.6688 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3098   -1.8423    0.7055 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7616   -4.5077   -0.7357 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8374   -4.5184    1.0473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4930   -4.1987    0.1007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9571   -2.6145   -0.5721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3186   -2.7250    2.2809 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6335   -3.4258    2.1611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4585   -2.2015   -1.5189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4878   -0.8254   -2.0546 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2124    0.8499    1.0011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8536   -0.3150    0.8215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1617    1.9427    0.1877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2017    1.6820   -2.1332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9536    2.9458   -1.9818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9867    4.5147    0.0413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4730    5.8493    1.4934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8507    5.2045    1.7756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7496    3.2239    0.5866 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2853    1.8848   -0.8808 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1737   -0.1926   -1.9851 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  1  0
 13 15  1  0
 13 16  1  0
  4 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  2  0
 22 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  1  0
 26 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 37 38  2  0
 38 39  1  0
 39 40  2  0
 33 41  1  0
 41  2  1  0
 12  7  1  0
 30 24  1  0
 40 35  1  0
  3 42  1  0
  3 43  1  0
  8 44  1  0
  9 45  1  0
 10 46  1  0
 11 47  1  0
 17 48  1  0
 17 49  1  0
 18 50  1  0
 18 51  1  0
 19 52  1  0
 19 53  1  0
 20 54  1  0
 20 55  1  0
 21 56  1  0
 25 57  1  0
 28 58  1  0
 29 59  1  0
 32 60  1  0
 32 61  1  0
 33 62  1  0
 34 63  1  0
 34 64  1  0
 36 65  1  0
 37 66  1  0
 38 67  1  0
 39 68  1  0
 40 69  1  0
 41 70  1  0
M  END
$$$$
