PUBCHEM-ZINC05458989
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 15  0  0  0  0  0  0  0  0999 V2000
    3.0170   -1.0840    0.4990 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9610   -0.0360    0.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0110    0.3990   -1.2690 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0390    0.0840   -2.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9700    0.4990   -3.6190 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1740    1.7170   -3.8750 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.2600    1.2250   -1.6760 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4140    2.3050   -1.0300 O   0  5  0  0  0  0  0  0  0  0  0  0
    2.9020   -1.9710   -0.1320 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0290   -0.6910    0.3560 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9250   -1.3980    1.5440 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9740   -0.4490    0.4150 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0930    0.8340    0.8270 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2100   -0.5410   -1.8220 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5960   -0.4330   -4.3940 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0390    0.6570   -2.4970 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2 12  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  2  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4 14  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  2  0  0  0  0
  7  8  1  0  0  0  0
  7 16  2  0  0  0  0
M  CHG  1   6  -1
M  CHG  1   8  -1
M  END