PUBCHEM-ZINC05605471
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
    0.0770    1.5170    0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0760    0.1440    0.0160 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0550   -0.6490   -0.0230 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9640   -1.6140   -0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2800   -0.0980   -0.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2550   -0.8300   -0.0800 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4670    1.2210   -0.0290 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.4440    2.0590    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7140    3.8000    0.0290 S   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4170   -0.4620    0.0390 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4040    0.2430   -0.0310 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0250    2.3580    0.0680 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.1240    3.8290   -0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9190    1.9890   -0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9010    3.3160    0.1610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5500   -1.8000    0.1390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4510   -2.1520    0.1510 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  8  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 13  1  0  0  0  0
 10 11  2  0  0  0  0
 10 16  1  0  0  0  0
 12 14  1  0  0  0  0
 12 15  1  0  0  0  0
 16 17  1  0  0  0  0
M  END