PUBCHEM-ZINC05178875
  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
    2.4760   -2.6620   -2.6170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5070   -4.5630   -2.3220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3010   -5.2050   -3.4620 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8710   -4.9070   -4.4180 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2440   -6.7050   -3.3310 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1730   -7.3060   -2.8460 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6860   -2.7300   -3.7780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3110   -2.0520   -3.7160 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
    1.9890   -4.7890   -1.3710 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4920   -4.9600   -2.3180 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7710   -3.7660   -3.5440 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
    1.1600   -7.3750   -3.7550 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7000   -4.7610   -3.3940 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.1220   -5.0260   -2.5170 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1050   -3.2020   -4.9620 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
    0.5760   -2.9730   -5.7380 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1690   -8.3360   -3.6500 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