PUBCHEM-ZINC01529821
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0850    1.3500   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0410   -0.0390   -0.1580 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1870   -0.6850   -0.2680 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3750    0.0480   -0.2330 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3330    1.4370   -0.0930 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1000    2.1000    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0570    3.6020    0.1720 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4390    4.0860    1.5520 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6390    3.3690    2.5290 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5770    5.5890    1.7570 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2920    6.2920    0.7390 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.2340   -0.8900   -0.3880 I   0  0  0  0  0  0  0  0  0  0  0  0
    1.1650   -2.0460   -0.4050 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0500    1.8430    0.0800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620   -0.6140   -0.1800 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2530    2.0170   -0.0570 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7410    4.0450   -0.5620 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0500    3.9730   -0.0530 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0940   -2.3350   -0.4160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9600    6.0020    2.8940 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4 12  1  0  0  0  0
  5  6  1  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 17  1  0  0  0  0
  7 18  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 20  2  0  0  0  0
 13 19  1  0  0  0  0
M  CHG  1  11  -1
M  END