OAKWOOD-ZINC04298487
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 19 19  0  0  0  0  0  0  0  0999 V2000
   -0.0450    1.2830    0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0210   -0.0490   -0.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2380   -0.7700   -0.1840 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3230   -1.9860   -0.3250 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3560    0.0390   -0.2070 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2540   -0.4150   -0.2910 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3800    1.4210   -0.1360 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4530    2.0180   -0.1820 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1250    2.0240   -0.0300 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0330    3.4920    0.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8970    4.0480    1.5100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4890    3.2360    2.3900 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2650   -0.7570    0.0540 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.2060   -0.3400   -0.6370 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3220   -1.7250    0.8220 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9650    1.8520    0.1410 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9300    3.9340   -0.3740 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1750    3.8330   -0.5140 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1830    5.2750    1.6250 O   0  5  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  9  1  0  0  0  0
  1 16  1  0  0  0  0
  2  3  1  0  0  0  0
  2 13  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  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
  7  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 17  1  0  0  0  0
 10 18  1  0  0  0  0
 11 12  2  0  0  0  0
 11 19  1  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1  13   1
M  CHG  1  15  -1
M  CHG  1  19  -1
M  END