NCID-ZINC04829199
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
   -0.0030    1.3440    0.1220 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0310   -0.0180   -0.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2630   -0.6570   -0.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4920    0.0260   -0.0950 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4580    1.4220    0.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1970    2.0440    0.2190 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1340    3.3940    0.4960 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6490    2.3390   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6260    2.0430   -0.7780 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.7280   -0.8300   -0.0180 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5900   -1.9630   -0.6140 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.2660   -2.0100   -0.5310 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9470    1.8640    0.2400 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8870   -0.5850   -0.2640 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1050    3.6730    0.6240 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2490   -2.2400   -0.6640 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4580    3.4630    0.5660 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6930   -0.4860    0.7250 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3 12  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5  8  1  0  0  0  0
  6  7  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  1  0  0  0  0
  8 17  2  0  0  0  0
 10 11  1  0  0  0  0
 10 18  2  0  0  0  0
 12 16  1  0  0  0  0
M  CHG  1   9  -1
M  CHG  1  11  -1
M  END