ACROSORGANICS-ZINC04261830
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  0  0  0  0  0  0999 V2000
   -0.0650    1.4300    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0780    0.0940    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1310   -0.5740   -0.1620 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0650   -1.5950   -0.1630 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3530    0.0270   -0.3130 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3980   -0.6000   -0.4530 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3220    1.4030   -0.2960 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2030    1.8820   -0.4050 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1890    2.1800   -0.1420 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2510    3.4050   -0.1390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3390   -0.8110    0.1540 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0580   -2.0470    0.1060 O   0  5  0  0  0  0  0  0  0  0  0  0
   -1.2610    2.2000    0.1730 N   0  3  0  0  0  0  0  0  0  0  0  0
   -1.8420    2.5550   -0.8630 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5600    2.5340    1.3280 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.4420   -0.2310    0.3010 O   0  0  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 13  1  0  0  0  0
  2  3  1  0  0  0  0
  2 11  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  1  0  0  0  0
  9 10  2  0  0  0  0
 11 12  1  0  0  0  0
 11 16  2  0  0  0  0
 13 14  2  0  0  0  0
 13 15  1  0  0  0  0
M  CHG  1  12  -1
M  CHG  1  13   1
M  CHG  1  15  -1
M  END