MAYBRIDGE-ZINC01042836
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
    0.0410    1.3710   -0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0650   -0.0220   -0.1070 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2840   -0.7020   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4520   -0.0150    0.1750 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3990    1.3360    0.2390 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2330    2.0720    0.1230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2040    3.5410    0.1930 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1800    4.1350    0.5140 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3450    4.2230   -0.1370 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2860   -2.2320   -0.0880 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1580   -2.8020   -0.2560 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9070    1.8960   -0.1200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8620   -0.5740   -0.2410 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3650    1.7980    0.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2050    3.8020   -0.4600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3200    5.2320   -0.0660 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4030   -2.8350    0.0130 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 12  1  0  0  0  0
  2  3  2  0  0  0  0
  2 13  1  0  0  0  0
  3  4  1  0  0  0  0
  3 10  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 14  1  0  0  0  0
  6  7  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
 10 11  1  0  0  0  0
 10 17  2  0  0  0  0
M  CHG  1  11  -1
M  END