
     RDKit          3D

 44 47  0  0  0  0  0  0  0  0999 V2000
    1.6723    3.0382    0.2014 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8277    1.8076    0.5638 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6500    2.1909    0.7669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2845    2.5700   -0.4969 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6976    2.4388   -0.6898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3585    3.4428   -1.0682 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3966    1.1541   -0.4989 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7752    0.9574   -0.4224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0563   -0.3674   -0.3681 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8980   -1.0021   -0.4126 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7042   -2.3419   -0.4407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3897   -2.8115   -0.5549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3339   -1.8766   -0.6205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6027   -0.5373   -0.6070 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8897   -0.1274   -0.4914 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0150   -2.3396   -0.7542 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0771   -2.1307    0.2401 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.5746   -1.5894    1.5869 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2154   -1.3173   -0.3578 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4243   -1.9830   -0.6492 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4768   -1.3179   -1.2788 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6290   -1.9782   -1.5529 F   0  0  0  0  0  0  0  0  0  0  0  0
    4.3339    0.0153   -1.6522 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1475    0.6935   -1.3768 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0930    0.0551   -0.7011 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9190    0.7698   -0.4247 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5025    3.3414   -0.8525 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7496    2.8168    0.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4234    3.8930    0.8655 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2075    1.4161    1.5333 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7287    3.0386    1.4815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1890    1.3394    1.2293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8151    3.3136   -1.0603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5290    1.7335   -0.4274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5404   -3.0278   -0.3915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1906   -3.8751   -0.5849 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1947   -3.0675   -1.4826 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4681   -3.1425    0.4910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0957   -2.3369    2.0625 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4327   -1.4083    2.2688 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0053   -0.6534    1.4758 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5518   -3.0296   -0.4014 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1393    0.5231   -2.1673 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0448    1.7123   -1.7205 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
  5  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 21 23  2  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26  2  1  0
 15  7  2  0
 25 19  1  0
 15 10  1  0
  1 27  1  0
  1 28  1  0
  1 29  1  0
  2 30  1  1
  3 31  1  0
  3 32  1  0
  4 33  1  0
  8 34  1  0
 11 35  1  0
 12 36  1  0
 16 37  1  0
 17 38  1  1
 18 39  1  0
 18 40  1  0
 18 41  1  0
 20 42  1  0
 23 43  1  0
 24 44  1  0
M  END
$$$$
