PUBCHEM-ZINC01532568
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 21 20  0  0  1  0  0  0  0  0999 V2000
   -0.0120    1.5450   -0.0400 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0120    0.0110    0.0250 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.5900   -0.3110    0.8840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4330   -0.5510    0.1540 C   0  0  3  0  0  0  0  0  0  0  0  0
   -2.0630   -0.1930   -0.6700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4540   -2.0820    0.1530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7980   -2.5010    0.4250 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7960   -3.4720    0.3750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0400   -0.1060    1.3720 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8110   -0.7010    1.4840 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5980   -0.5240   -1.1560 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4820   -0.0900   -1.2100 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3990    2.0700   -0.1870 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3300    1.3700   -0.5900 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900    3.5340    0.1000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6680    4.2400    0.3620 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.5790    1.8940   -0.9100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4540    1.9580    0.8720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1430   -2.4930   -0.8110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8200   -2.4840    0.9500 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9000    3.9160    0.0560 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 13  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  1  0  0  0  0
  6  7  1  0  0  0  0
  6 19  1  0  0  0  0
  6 20  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
 15 16  1  0  0  0  0
 15 21  2  0  0  0  0
M  CHG  1  16  -1
M  END