KEYORGANICS-ZINC03884275
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 17  0  0  1  0  0  0  0  0999 V2000
   -0.0340    1.6460   -0.1280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0220    0.1390    0.0290 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5200   -0.1620    0.9320 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4470   -0.4760    0.1120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5480   -1.4730   -0.6780 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1580   -0.8250   -1.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9010   -0.4900   -2.3250 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1450    0.1450   -3.1310 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9810    2.0410   -0.2350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6150    1.9500   -1.0060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4870    2.1250    0.7470 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2100   -1.8900   -0.7750 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5790   -0.2260   -0.2010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2660    0.0520    0.9020 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.7040   -0.4700   -1.1460 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.0920   -1.2920   -1.3800 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6830    0.1050   -2.0230 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0950   -0.8690   -2.4130 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 15  1  0  0  0  0
  4  5  2  0  0  0  0
  4 14  1  0  0  0  0
  6  7  1  0  0  0  0
  6 12  1  0  0  0  0
  6 13  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  2  0  0  0  0
  7 18  1  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
M  CHG  1  14  -1
M  CHG  1  15   1
M  CHG  1  18  -1
M  END