NCID-ZINC01706921
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  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  3  0  0  0  0  0  0  0  0  0
    0.5880   -0.3550   -0.8470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4080   -0.5250   -0.1110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9900   -0.9110    0.8750 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830    2.1540   -0.0020 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.3450    1.7520    1.1890 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4540    3.9530    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8000    4.6310    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8100    3.9680   -0.0130 O   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
    0.0800   -0.1800    2.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8900    4.2540   -0.8740 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9070    4.2440    0.9060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0160   -0.5600   -1.3070 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6060   -0.4920    1.2490 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6900   -1.4980    1.2400 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8770    5.9710    0.0070 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7620    6.3600    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9200   -0.9020   -1.3300 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  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  4  1  0  0  0  0
  2 17  1  0  0  0  0
  4  5  2  0  0  0  0
  4 16  1  0  0  0  0
  6  7  2  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
  9 10  2  0  0  0  0
  9 19  1  0  0  0  0
 13 17  1  0  0  0  0
 16 21  1  0  0  0  0
 17 18  1  0  0  0  0
 19 20  1  0  0  0  0
M  END