NCID-ZINC01689749
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  1  0  0  0  0  0999 V2000
   -0.0570    1.6560    0.3510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020    0.1500    0.1020 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5850   -0.0370   -0.8080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3920   -0.4640   -0.0530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1140   -0.1200   -1.3570 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3830    0.2390   -2.3210 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7500   -0.5060    1.2570 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2060   -0.7870    2.3260 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2220   -0.7600    1.0510 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9500    2.0710    0.4710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5370    2.1800   -0.4800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6150    1.8850    1.2660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3160   -1.5590   -0.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0270   -0.1690    0.7930 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3620   -1.4340    0.2030 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7380    0.1860    0.8720 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6430   -1.2280    1.9450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3700   -0.2530   -1.3100 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4 13  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  2  0  0  0  0
  5 18  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 15  1  0  0  0  0
  9 16  1  0  0  0  0
  9 17  1  0  0  0  0
M  CHG  1  18  -1
M  END