NCID-ZINC04430844
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 17  0  0  0  0  0  0  0  0999 V2000
    0.0410    1.4750    0.0260 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0500    0.0910    0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0660   -0.6480   -0.0080 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.2550   -0.0840   -0.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3980    1.2700   -0.0320 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2840    1.6630   -0.0520 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3090    2.0660   -0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4280    3.2810    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3720   -0.8760   -0.0650 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2860   -0.5220    0.0500 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1800    2.3120    0.0530 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2770    1.7900   -0.0340 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0880    3.5210    0.1620 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.2820   -1.8420   -0.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2530   -0.4710   -0.0850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0940    0.0120   -0.0070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3470   -1.4880    0.1250 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  7  1  0  0  0  0
  1 11  1  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  7  8  2  0  0  0  0
  9 14  1  0  0  0  0
  9 15  1  0  0  0  0
 10 16  1  0  0  0  0
 10 17  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END