MAYBRIDGE-ZINC04323485
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 22 22  0  0  0  0  0  0  0  0999 V2000
   -0.0100    1.4970    0.1100 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0080   -0.0100    0.0800 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0640   -0.6040    0.0760 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1460   -0.6930    0.0560 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0680   -1.9080    0.0320 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1530   -2.6300    0.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4750   -1.9820    0.1360 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6410   -0.5950    0.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9090   -0.2090    0.2740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9540   -1.6180    0.3760 S   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6230   -2.6780    0.2420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3690    1.1980    0.3180 N   0  3  0  0  0  0  0  0  0  0  0  0
   -4.5620    2.1060    0.2400 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5560    1.4460    0.4330 O   0  5  0  0  0  0  0  0  0  0  0  0
   -2.0670   -4.0030   -0.1360 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.0140    1.8720    0.1260 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5200    1.8730   -0.7760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5340    1.8360    1.0040 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8180    0.0990    0.0720 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6920   -3.7560    0.2440 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2000   -4.4290   -0.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8750   -4.5400   -0.1530 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6 15  1  0  0  0  0
  7  8  1  0  0  0  0
  7 11  2  0  0  0  0
  8  9  2  0  0  0  0
  8 19  1  0  0  0  0
  9 10  1  0  0  0  0
  9 12  1  0  0  0  0
 10 11  1  0  0  0  0
 11 20  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 15 21  1  0  0  0  0
 15 22  1  0  0  0  0
M  CHG  1  12   1
M  CHG  1  14  -1
M  END