CHEMSTAR-ZINC01688380
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.2040    1.3190   -0.1150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0840   -0.0520   -0.3170 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1750   -0.6590   -0.2570 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3370    0.0820    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1900    1.4600    0.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9340    2.0750    0.1470 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5520   -0.5690    0.0240 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.8640    0.0810    0.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6300    0.3200    1.7010 S   0  0  0  0  0  0  0  0  0  0  0  0
    4.7890    1.3190    2.3610 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5990   -1.0140    2.3030 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1780    1.7950   -0.1570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9650   -0.6530   -0.5210 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2440   -1.7320   -0.4230 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0510    2.0820    0.4360 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8510    3.1450    0.3170 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5640   -1.5810    0.0440 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5650   -0.5660   -0.4620 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8710    1.0450   -0.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9720    0.7970    1.3620 O   0  5  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 14  1  0  0  0  0
  4  5  2  0  0  0  0
  4  7  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6 16  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  2  0  0  0  0
  9 20  1  0  0  0  0
M  CHG  1  20  -1
M  END