NCID-ZINC04722707
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  1  0  0  0  0  0999 V2000
    0.0630    1.5530    0.2300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4720    0.1110    0.2170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2240   -0.6520   -1.0850 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.5910   -0.0750   -1.9420 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5620   -0.9570   -1.2630 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.2130    0.9750   -1.4760 S   0  0  0  0  0  0  0  0  0  0  0  0
    1.5700    1.7710    0.0410 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.7120    2.8500   -0.1040 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5370    1.3900    1.1810 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0400    0.7270    2.1350 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8590   -2.0560   -1.1560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1680   -2.5980   -0.0560 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4710    2.1190   -0.5460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2340    2.0090    1.1840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0750   -0.4410    1.0780 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5570    0.1610    0.3830 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7120    1.8590    1.0820 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.0560   -2.4950   -2.3300 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  7  1  0  0  0  0
  1 13  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3 11  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 17  1  0  0  0  0
 11 12  2  0  0  0  0
 11 18  1  0  0  0  0
M  CHG  1  17  -1
M  CHG  1  18  -1
M  END