KEYORGANICS-ZINC01403891
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 21  0  0  0  0  0  0  0  0999 V2000
   -0.5400    1.4460    0.0900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2460   -0.0310    0.0400 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1250   -0.6950    1.1730 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3980   -2.0570    1.1380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3000   -2.7600   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0770   -2.1100   -1.2020 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3590   -0.7300   -1.1670 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7260   -0.3520   -2.5280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6640   -1.4220   -3.2680 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2620   -2.5180   -2.4970 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1440   -3.4230   -2.8240 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2400    0.0420    2.4510 N   0  3  0  0  0  0  0  0  0  0  0  0
    0.6730    1.1810    2.4600 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0990   -0.4890    3.4930 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.3910    2.0050   -0.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2070    1.7120   -0.7310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0160    1.6900    1.0390 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6900   -2.5660    2.0440 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5150   -3.8190   -0.0440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0000    0.6380   -2.8620 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  1  0  0  0  0
  2  7  2  0  0  0  0
  3  4  2  0  0  0  0
  3 12  1  0  0  0  0
  4  5  1  0  0  0  0
  4 18  1  0  0  0  0
  5  6  2  0  0  0  0
  5 19  1  0  0  0  0
  6  7  1  0  0  0  0
  6 10  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 20  1  0  0  0  0
  9 10  1  0  0  0  0
 10 11  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  14  -1
M  END