SIAL-ZINC04764152
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 16  0  0  1  0  0  0  0  0999 V2000
    0.0970    1.6680   -0.3030 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2100    0.1800   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7820   -0.6470   -1.1630 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.2160   -0.4680   -2.0840 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6120   -2.1330   -0.7230 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6800   -2.6700   -0.2920 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1960   -0.3440   -1.4190 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.6640    0.6350   -2.2490 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000    1.4150   -2.9170 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0820    2.1320   -0.4040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4700    1.8420   -1.2220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4210    2.1770    0.5160 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8280    0.0490    0.8970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7930   -0.1840    0.2560 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8340   -0.9720   -0.9290 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7660    0.6500   -2.2660 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460   -2.6180   -0.8550 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 13  1  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  7  1  0  0  0  0
  5  6  2  0  0  0  0
  5 17  1  0  0  0  0
  7  8  1  0  0  0  0
  7 15  1  0  0  0  0
  8  9  2  0  0  0  0
  8 16  1  0  0  0  0
M  CHG  1  17  -1
M  END