PUBCHEM-ZINC01532858
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 27 26  0  0  1  0  0  0  0  0999 V2000
   -0.1240    1.3400   -0.1690 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0350   -0.1660   -0.3540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2710   -0.7550   -0.3330 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2790   -2.1210   -0.2980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2780   -2.8240   -0.3220 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7030   -2.6180   -0.2500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7960   -4.0100    0.3590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2330   -4.4890    0.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1270   -3.8480   -0.0560 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2070    2.0690   -0.0930 C   0  0  3  0  0  0  0  0  0  0  0  0
    1.8770    1.8110   -0.9200 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0200    3.6090   -0.0310 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5600    4.0200    1.0590 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7230    1.7310   -1.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7250    1.5400    0.7280 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5110   -0.3810   -1.3180 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6410   -0.5890    0.4550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2940   -1.9190    0.3540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0970   -2.6100   -1.2730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2840   -4.7370   -0.2830 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2850   -4.0240    1.3300 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3440   -5.4830    1.3340 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.4340    4.1870   -0.9700 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.9370    1.7000    1.1870 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.8950    1.3640    1.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    1.1420    1.8610 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0210    2.6900    1.6000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2  3  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 18  1  0  0  0  0
  6 19  1  0  0  0  0
  7  8  1  0  0  0  0
  7 20  1  0  0  0  0
  7 21  1  0  0  0  0
  8  9  2  0  0  0  0
  8 22  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  1  0  0  0  0
 10 24  1  0  0  0  0
 12 13  2  0  0  0  0
 12 23  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 24 27  1  0  0  0  0
M  CHG  1  22  -1
M  CHG  1  23  -1
M  CHG  1  24   1
M  END