KEYORGANICS-ZINC01403825
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 23 24  0  0  0  0  0  0  0  0999 V2000
   -0.0180    1.4480    0.0100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0020   -0.0040    0.0020 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6010   -0.6020   -1.0480 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0930    0.0710   -1.9320 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6590   -2.0680   -1.1220 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2280   -2.7570   -2.1180 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1740   -4.1540   -1.9950 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6810   -5.1430   -2.8730 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5330   -6.4630   -2.5840 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8820   -6.8670   -1.4250 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3790   -5.9310   -0.5530 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5200   -4.5670   -0.8280 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0030   -3.1560    0.0850 S   0  0  0  0  0  0  0  0  0  0  0  0
    2.0690   -7.4810   -3.5160 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6400   -7.1340   -4.5340 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9400   -8.6650   -3.2630 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.0050    1.8250    0.0020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5450    1.8090   -0.8730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5280    1.7990    0.9070 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6980   -2.2700   -2.9600 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1880   -4.8460   -3.7790 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7720   -7.9190   -1.2080 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1260   -6.2500    0.3470 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  5 13  1  0  0  0  0
  6  7  1  0  0  0  0
  6 20  1  0  0  0  0
  7  8  1  0  0  0  0
  7 12  2  0  0  0  0
  8  9  2  0  0  0  0
  8 21  1  0  0  0  0
  9 10  1  0  0  0  0
  9 14  1  0  0  0  0
 10 11  2  0  0  0  0
 10 22  1  0  0  0  0
 11 12  1  0  0  0  0
 11 23  1  0  0  0  0
 12 13  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
M  CHG  1  14   1
M  CHG  1  16  -1
M  END