IBS-ZINC05429131 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 1 0 0 0 0 0999 V2000 0.2340 2.2690 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 0.7830 0.2610 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9820 0.5740 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 0.3810 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -0.8680 -1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.0660 1.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -0.7570 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -0.6080 2.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -1.6320 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -2.5310 3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -2.9350 4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -3.4570 5.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -3.7540 5.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -3.4160 4.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9410 -2.9460 3.4190 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 -3.4610 3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3210 -2.8470 1.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -2.8870 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6200 -3.5380 1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5960 -4.1490 2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -4.1070 3.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4580 -4.7130 4.8880 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -1.3280 2.7450 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -0.2210 1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3810 0.4820 0.5610 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 2.6330 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 2.8680 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 2.4710 1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -3.0320 4.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -3.6020 6.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 -4.1640 6.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -2.3230 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4930 -2.4040 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5210 -3.5690 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4750 -4.6600 3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 1.3300 -2.0250 O 0 5 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 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M CHG 1 36 -1 M END