
     RDKit          3D

 69 72  0  0  0  0  0  0  0  0999 V2000
    5.6832   -2.2393   -0.7760 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5243   -2.3703   -1.7602 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4791   -1.3792   -1.4612 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1555   -1.8198   -1.0092 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0984   -1.8651    0.5202 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6914   -2.2203    1.0374 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1641   -0.9910    1.3973 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7617   -0.3246    0.2222 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5089   -1.0984   -0.7458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2135   -1.0044   -1.9698 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6014   -2.0198   -0.3440 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3274   -1.8252    0.8426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3604   -2.6961    1.1949 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6920   -3.7833    0.3732 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8413   -4.6975    0.7174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9763   -4.2867    0.0366 F   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0999   -4.6848    2.0781 F   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5391   -5.9983    0.3466 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9946   -3.9577   -0.8316 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9580   -3.0895   -1.1822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7758    1.1571    0.1640 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2125    1.6858    0.3706 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2626    3.1869    0.5157 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6833    3.8112    1.6369 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7089    5.2034    1.7618 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3256    5.9826    0.7794 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9224    5.3703   -0.3242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8854    3.9778   -0.4635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1497    1.7082   -1.1397 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1948    1.2645   -1.3031 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2997    1.6941   -0.5447 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2076    2.7520    0.3858 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3201    3.1307    1.1432 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5383    2.4726    0.9686 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6515    1.4440    0.0317 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5442    1.0546   -0.7317 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7247    0.0084   -1.7588 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2024    0.3364   -2.8794 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4340   -3.0300   -0.9778 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1820   -1.2495   -0.8883 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3118   -2.3438    0.2670 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1196   -3.4050   -1.6891 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8987   -2.2327   -2.8007 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3718   -1.1646   -1.4261 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9392   -2.8404   -1.3995 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8063   -2.6601    0.8517 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4618   -0.9072    0.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8242   -2.8035    1.9760 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1579   -2.8965    0.3353 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4530   -0.2874    1.9975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9699   -1.3204    2.0820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1246   -0.9921    1.4953 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9069   -2.5097    2.1096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2645   -4.7552   -1.5102 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4430   -3.2497   -2.1168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1741    1.5555    1.0039 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6270    1.2446    1.3036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8597    1.3487   -0.4692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2103    3.2232    2.4117 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2534    5.6784    2.6211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3471    7.0618    0.8779 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4036    5.9745   -1.0819 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3456    3.5204   -1.3306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7414    1.3800   -2.0203 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1761    2.8179   -1.1613 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2880    3.2966    0.5257 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2387    3.9317    1.8635 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4006    2.7631    1.5533 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6093    0.9625   -0.1093 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  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  1  0
 15 17  1  0
 15 18  1  0
 14 19  1  0
 19 20  2  0
  8 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  2  0
 21 29  1  0
 29 30  1  0
 30 31  1  0
 31 32  2  0
 32 33  1  0
 33 34  2  0
 34 35  1  0
 35 36  2  0
 36 37  1  0
 37 38  2  0
 37  3  1  0
 20 11  1  0
 28 23  1  0
 36 31  1  0
  1 39  1  0
  1 40  1  0
  1 41  1  0
  2 42  1  0
  2 43  1  0
  4 44  1  0
  4 45  1  0
  5 46  1  0
  5 47  1  0
  6 48  1  0
  6 49  1  0
  7 50  1  0
  7 51  1  0
 12 52  1  0
 13 53  1  0
 19 54  1  0
 20 55  1  0
 21 56  1  0
 22 57  1  0
 22 58  1  0
 24 59  1  0
 25 60  1  0
 26 61  1  0
 27 62  1  0
 28 63  1  0
 29 64  1  0
 29 65  1  0
 32 66  1  0
 33 67  1  0
 34 68  1  0
 35 69  1  0
M  END
$$$$
