APOLLO-ZINC04255671
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  0  0  0  0  0  0999 V2000
    0.3370    1.4210    0.8120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0500    0.1060    0.5010 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9030   -0.6130   -0.3170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0430   -0.0180   -0.8230 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3320    1.2980   -0.5120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4790    2.0190    0.3060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7600    3.3050    0.6100 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.9550   -0.7890   -1.6970 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.1600   -0.6430   -1.6000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5000   -1.5700   -2.5130 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5940   -2.0220   -0.6500 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5580   -2.3620   -0.8540 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4920   -2.8420   -0.7200 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3310    1.9840    1.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8400   -0.3610    0.8960 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2230    1.7630   -0.9080 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  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
  3  4  2  0  0  0  0
  3 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  5  6  2  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1   8   1
M  CHG  1  10  -1
M  CHG  1  11   1
M  CHG  1  13  -1
M  END