IBS-ZINC04887453
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  0  0  0  0  0  0999 V2000
   -0.0190    1.5260    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4330   -0.5340    0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1420   -0.0480   -1.1740 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.6830   -0.2530   -2.2840 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1900    0.5600   -1.0510 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.4130   -1.9980    0.0050 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.0020   -2.6200    0.8710 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8080   -2.5950   -0.8680 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.0880   -0.0820    1.1640 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.3950    2.0470    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3240    1.2750   -0.0130 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8870   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8770    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5120   -0.3560   -0.8950 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5290   -0.3650    0.8850 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6220    3.3700    0.0050 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5460    3.6570   -0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 11  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  3 10  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 11 12  2  0  0  0  0
 11 17  1  0  0  0  0
 17 18  1  0  0  0  0
M  CHG  1   4   1
M  CHG  1   6  -1
M  CHG  1   7   1
M  CHG  1   9  -1
M  END