PUBCHEM-ZINC01436098
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  0  0  0  0  0  0999 V2000
   -0.0820    1.3840   -0.2020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.0010   -0.2370 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0780   -0.7340   -0.1360 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2650   -0.0720    0.0060 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3050    1.3270    0.0420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1220    2.0690   -0.0610 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1560    3.5710    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3230    4.0630    1.4480 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3210    5.4860    1.4590 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4870    5.7570    2.3780 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5790   -0.8490    0.1400 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6490   -0.1630    0.2520 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.0280    1.9090   -0.2810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9620   -0.5770   -0.3480 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2610    1.8340    0.1560 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9700    3.9560   -0.6120 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2420    3.9980   -0.4190 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5030    3.7110    2.0840 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2690    3.7160    1.8780 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5260   -2.1210    0.1360 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 13  1  0  0  0  0
  2  3  2  0  0  0  0
  2 14  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 11  1  0  0  0  0
  5  6  1  0  0  0  0
  5 15  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7 16  1  0  0  0  0
  7 17  1  0  0  0  0
  8  9  1  0  0  0  0
  8 18  1  0  0  0  0
  8 19  1  0  0  0  0
  9 10  1  0  0  0  0
 11 12  1  0  0  0  0
 11 20  2  0  0  0  0
M  CHG  1  12  -1
M  END