ACROSORGANICS-ZINC03958399
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.0630    1.4960   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0600    0.1190   -0.0200 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0800   -0.6670   -0.0220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4580    1.1850    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3490    2.0500    0.0120 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5370    3.5100    0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6530    3.9810   -0.0650 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7370    1.7080    0.0240 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3990   -0.5110   -0.0360 N   0  3  0  0  0  0  0  0  0  0  0  0
   -2.3990    0.1850   -0.0330 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5020   -1.7240   -0.0500 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.8120    2.1290   -0.0050 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9820   -1.7420   -0.0360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8700    2.6670   -0.0450 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5020    1.1170    0.1030 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2830   -0.1270   -0.0080 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4700    4.3260    0.1520 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6440    5.2770    0.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  5  1  0  0  0  0
  1 12  1  0  0  0  0
  2  3  1  0  0  0  0
  2  9  1  0  0  0  0
  3 13  1  0  0  0  0
  3 16  2  0  0  0  0
  4  5  2  0  0  0  0
  4  8  1  0  0  0  0
  4 16  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 17  1  0  0  0  0
  8 14  1  0  0  0  0
  8 15  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 17 18  1  0  0  0  0
M  CHG  1   9   1
M  CHG  1  11  -1
M  END