ACROSORGANICS-ZINC03861250
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 16 16  0  0  0  0  0  0  0  0999 V2000
    0.3370    1.4210    0.8120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0500    0.1060    0.5000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9030   -0.6130   -0.3170 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0430   -0.0160   -0.8220 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3310    1.2990   -0.5110 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4780    2.0190    0.3060 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8380    3.6720    0.6970 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.9560   -0.7870   -1.6960 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.1610   -0.6390   -1.5990 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5020   -1.5680   -2.5130 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5960   -2.0220   -0.6500 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.5550   -2.3620   -0.8540 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4950   -2.8410   -0.7200 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.3320    1.9840    1.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8400   -0.3610    0.8950 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2220    1.7650   -0.9050 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  6  1  0  0  0  0
  1 14  1  0  0  0  0
  2  3  1  0  0  0  0
  2 15  1  0  0  0  0
  3  4  2  0  0  0  0
  3 11  1  0  0  0  0
  4  5  1  0  0  0  0
  4  8  1  0  0  0  0
  5  6  2  0  0  0  0
  5 16  1  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  8 10  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1   8   1
M  CHG  1  10  -1
M  CHG  1  11   1
M  CHG  1  13  -1
M  END