PUBCHEM-ZINC05178876
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 31 30  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  0  0  0  0  0  0  0  0  0  0
    0.8510   -0.5890   -1.4900 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.7750   -2.3940   -1.3220 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4610   -3.0470   -2.5240 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.0100   -2.6770   -3.4450 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2880   -4.5650   -2.4460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8640   -5.2100   -3.7090 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.9000   -4.8960   -3.8360 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8060   -6.7100   -3.5790 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9200   -7.3290   -4.1180 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9290   -2.7070   -2.5110 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3800   -2.0130   -1.6310 O   0  0  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   -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
    1.2830   -2.6950   -0.4060 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2670   -2.7110   -1.2820 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8150   -4.9460   -1.5710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2280   -4.8070   -2.3660 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4760   -5.1490   -5.7300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2750    1.6250    2.0510 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7380   -7.3580   -2.8630 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0770   -4.7880   -4.8760 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1120   -5.0680   -4.7810 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7340   -3.1750   -3.4770 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7060    2.0000    1.2190 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7330    3.0080    1.2480 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6690   -2.9300   -3.4260 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6590   -8.3200   -2.8080 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 28  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 12  1  0  0  0  0
  7  8  1  0  0  0  0
  7 20  1  0  0  0  0
  7 21  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 25  1  0  0  0  0
 10 11  2  0  0  0  0
 10 24  1  0  0  0  0
 12 13  2  0  0  0  0
 12 27  1  0  0  0  0
 22 25  1  0  0  0  0
 23 28  1  0  0  0  0
 24 31  1  0  0  0  0
 25 26  1  0  0  0  0
 27 30  1  0  0  0  0
 28 29  1  0  0  0  0
M  END