KEYORGANICS-ZINC00169194
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 17 18  0  0  0  0  0  0  0  0999 V2000
   -0.0160    1.3620    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2190   -0.6810   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4200    0.0550   -0.0210 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5010   -0.9240   -0.0360 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9630   -2.1110   -0.0380 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.5680   -2.0060   -0.0240 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9480   -2.7510   -0.0220 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3740    1.4540   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1670    2.0900    0.0020 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6290    2.2390   -0.0200 N   0  3  0  0  0  0  0  0  0  0  0  0
    3.5860    3.4560   -0.0140 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7050    1.6680   -0.0330 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9630    1.8830    0.0170 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9250   -0.5580    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5590   -0.7050   -0.0460 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1310    3.1690    0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 10  2  0  0  0  0
  1 14  1  0  0  0  0
  2  3  2  0  0  0  0
  2 15  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  4  5  1  0  0  0  0
  4  9  2  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
  7  8  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
 10 17  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  CHG  1  11   1
M  CHG  1  13  -1
M  END