PUBCHEM-ZINC06036103
  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  3  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
    0.7420   -0.5110    1.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6570   -2.0140    1.2980 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0650   -2.6190    0.4350 O   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
   -0.2400   -0.0280   -2.8270 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3470   -0.4510   -4.1750 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.4340   -1.5370   -4.2090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5600    0.0150   -5.2860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1410    0.7720   -6.1290 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6720    0.1510   -4.3420 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.8970    0.9680   -3.8690 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5790   -0.4300   -5.1510 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2990   -1.4510   -5.7420 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9420    0.1890   -5.3220 C   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    1.8770    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7880   -0.2080    1.1900 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2850   -0.0870    2.1360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2260   -0.4760   -2.7030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3270    1.0580   -2.7930 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0090    1.0940   -4.7180 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7060   -0.5200   -5.0010 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0980    0.4400   -6.3720 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2380   -2.6820    2.3060 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8310   -0.4110   -5.3370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3740   -0.0850   -6.0680 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1570   -3.6460    2.3000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4 21  1  0  0  0  0
  4 22  1  0  0  0  0
  5  6  2  0  0  0  0
  5 28  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 23  1  0  0  0  0
  8 24  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 13  1  0  0  0  0
 11 12  2  0  0  0  0
 11 29  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 17  1  0  0  0  0
 17 25  1  0  0  0  0
 17 26  1  0  0  0  0
 17 27  1  0  0  0  0
 28 31  1  0  0  0  0
 29 30  1  0  0  0  0
M  END