CHEMBRIDGE-ZINC02898852 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.3640 0.8730 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 0.0920 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -0.5560 1.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -1.3330 2.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9750 -1.9910 1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6900 -1.8760 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 -1.0980 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.4370 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -2.5440 0.5860 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -1.9440 0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 -0.7470 0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1030 -3.0260 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4460 -2.9030 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3030 -4.0950 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8690 -5.2420 0.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6760 -6.3560 0.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9210 -6.3430 0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3570 -5.2070 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5600 -4.0850 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6830 -5.2010 -0.9830 N 0 3 0 0 0 0 0 0 0 0 0 0 -13.0660 -4.2060 -1.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.3910 -6.1910 -0.9360 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.3590 -4.2120 0.3920 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -3.8770 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -5.0020 0.6490 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 1.3350 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 0.2310 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 1.6500 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -1.4230 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3610 -2.5960 2.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7490 -1.0080 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6050 0.1710 -0.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8850 -1.9290 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9020 -5.2540 1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3420 -7.2420 1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9020 -3.2010 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7130 -5.1130 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7130 -7.4450 0.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3110 -7.4650 1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END