NCID-ZINC01735154
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0190    1.5260    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6820   -0.4720   -1.1930 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7870   -1.8080   -1.3540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3220   -2.5590   -0.5180 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4590   -2.3520   -2.5350 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6290   -3.6800   -2.8100 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2960   -3.9100   -3.9890 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6620   -2.8110   -4.6580 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1730   -1.4010   -3.8310 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.3900   -2.8170   -5.9470 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.6960   -3.8740   -6.4690 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6830   -1.7640   -6.4860 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0040    1.9030    0.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5460    1.8870   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    1.8770    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5290   -0.3650    0.8850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0200   -0.3810    0.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2730   -4.4700   -2.1650 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5100   -4.9060   -4.3480 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2 17  1  0  0  0  0
  2 18  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  7 19  1  0  0  0  0
  8  9  2  0  0  0  0
  8 20  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END