ACROSORGANICS-ZINC01764711
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 18 18  0  0  0  0  0  0  0  0999 V2000
    0.0080    1.3840    0.2210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0200    0.0110   -0.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1640   -0.7120   -0.2800 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3760   -0.0050   -0.2550 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4320    1.3710    0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2360    2.0550    0.2540 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2670    3.4930    0.5330 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.1920    4.0580    0.7770 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3680    4.0610    0.5090 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.6350   -0.6560   -0.5770 N   0  3  0  0  0  0  0  0  0  0  0  0
    4.4830   -0.7110    0.3260 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8100   -0.9820   -1.7600 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0910   -2.1950   -0.5060 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0820   -2.8760   -0.1070 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9320    1.9010    0.4000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9780   -0.5100   -0.0640 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3900    1.8870    0.0220 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0340   -2.6380   -1.0490 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  1 15  1  0  0  0  0
  2  3  2  0  0  0  0
  2 16  1  0  0  0  0
  3  4  1  0  0  0  0
  3 13  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  5 17  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  7  9  1  0  0  0  0
 10 11  2  0  0  0  0
 10 12  1  0  0  0  0
 13 14  1  0  0  0  0
 13 18  2  0  0  0  0
M  CHG  1   7   1
M  CHG  1   9  -1
M  CHG  1  10   1
M  CHG  1  12  -1
M  CHG  1  14  -1
M  END