IBS-ZINC05186478 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 0.2080 1.4280 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -0.0490 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3990 -0.5350 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -1.9050 1.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -2.7920 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -2.3250 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.9530 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.5380 0.4680 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -5.1800 -0.4240 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -4.6850 1.9060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -4.9840 0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8990 -4.8430 -1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -5.7100 -2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -5.5620 -3.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8480 -4.5590 -3.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -3.7100 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -3.8530 -1.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2800 -2.6500 -3.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7660 -2.4760 -4.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -1.4550 -4.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -1.1780 -5.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -0.1140 -5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 0.1890 -6.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5680 -0.5640 -8.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6610 -1.6290 -7.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -1.9300 -6.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2590 -0.2360 -9.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0650 0.7460 -9.3720 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1430 1.8370 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 1.6390 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 1.9440 -0.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 0.1560 1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8550 -2.2640 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 -3.0100 -1.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -0.5900 -2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 -6.5000 -1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 -6.2310 -4.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2100 -4.4510 -4.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -3.2040 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -2.0060 -2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8810 -0.8640 -3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 0.4940 -4.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5180 1.0220 -6.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4490 -2.2310 -8.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3260 -2.7620 -6.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9840 -0.9650 -10.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 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 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 2 0 0 0 0 M CHG 1 28 -1 M END