ligand
  ligand 3D structure with hydrogens

 29 30  0     1  0  0  0  0  0999 V2000
   -0.6044    2.5123    0.5957 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2182    1.3433    1.1413 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0664    0.2265    0.1248 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.7204   -0.9614    0.6072 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3084   -1.6504   -0.5127 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7276   -1.7202   -0.3038 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3934   -0.8341    0.4060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6208   -1.0571    0.8004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2855   -2.0959    0.3674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6877   -2.9636   -0.4547 N   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3973   -2.7867   -0.8042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8177   -3.6752   -1.6236 O   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5773   -2.3320    0.6673 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9326   -0.8567   -1.7476 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8702   -0.8911   -2.7098 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7857   -1.3511   -2.2703 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7195    0.5339   -1.2100 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.8792    1.3101   -2.0375 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6845    3.2301    1.2129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2837    1.5329    1.3379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7399    1.0657    2.0922 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0015    0.1457   -0.1009 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0330   -2.7118   -0.5690 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9158    0.0982    0.6687 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0907   -0.3741    1.4927 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9036   -3.1577    0.2072 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1345   -1.7592    1.2685 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6299    1.1310   -1.0421 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7741    2.1756   -1.6600 H   0  0  0  0  0  0  0  0  0  0  0  0
 17 18  1  0  0  0  0
 14 16  1  0  0  0  0
 11 12  2  0  0  0  0
 14 17  1  0  0  0  0
  3 17  1  0  0  0  0
  5 14  1  0  0  0  0
 14 15  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  6 11  1  0  0  0  0
 10 11  1  0  0  0  0
  3  4  1  0  0  0  0
  2  3  1  0  0  0  0
  6  7  1  0  0  0  0
  9 10  2  0  0  0  0
  1  2  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 13  1  0  0  0  0
  1 19  1  0  0  0  0
  2 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3 22  1  0  0  0  0
  5 23  1  0  0  0  0
  7 24  1  0  0  0  0
  8 25  1  0  0  0  0
 13 26  1  0  0  0  0
 13 27  1  0  0  0  0
 17 28  1  0  0  0  0
 18 29  1  0  0  0  0
M  END
$$$$
