PUBCHEM-ZINC05157194
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  1  0  0  0  0  0999 V2000
   -0.1830    1.6690    0.1620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2210    0.1390    0.1290 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.9120   -0.2390    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1670   -0.3600    0.4340 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9360    0.6700    0.2720 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4190    0.5980    0.3740 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1470    1.7810   -0.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3460    1.7540   -0.4570 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3820    3.0710   -0.3810 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9850    4.1120   -0.6100 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9170    3.0580   -0.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2700    1.9430    0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6580   -0.3650   -1.2740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0760    0.1740   -2.2620 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7840    2.1420   -0.6210 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5320    2.0300    1.1370 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6870    0.5040    1.4310 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7550   -0.2980   -0.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4000    3.9910   -0.4720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5740   -1.2380   -1.2630 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 12  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 13  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  6 18  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 11 12  2  0  0  0  0
 11 19  1  0  0  0  0
 13 14  2  0  0  0  0
 13 20  1  0  0  0  0
M  CHG  1  20  -1
M  END