CHEMBRIDGE-ZINC02858488 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 0 0 0 0 0 0999 V2000 0.8540 2.4480 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 0.9280 1.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7390 0.5420 2.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 0.4540 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 0.1450 -0.4480 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1460 0.8200 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 0.2470 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1730 0.7920 -1.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9590 0.4260 -2.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5440 -0.3550 -3.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 0.9860 -3.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0150 0.4220 -4.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9200 -0.6160 -4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5280 -1.1330 -5.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2300 -0.6130 -6.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3240 0.4250 -6.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7130 0.9390 -5.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 2.0470 -5.7180 N 0 3 0 0 0 0 0 0 0 0 0 0 6.5550 2.5760 -6.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1220 2.4290 -4.7400 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8730 2.7860 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 2.7230 0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 2.9180 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 1.0120 3.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.5420 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 0.8800 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 0.7290 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -0.6300 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 0.9240 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0950 1.9060 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 0.5480 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -0.8380 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 0.5200 -2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5040 1.4170 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3010 2.0720 -3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9320 0.7140 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1530 -1.0230 -3.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 -1.9440 -5.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7050 -1.0170 -7.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0920 0.8320 -7.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END