IBS-ZINC05563189 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 -2.0340 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 -2.5330 2.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.8990 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -3.2980 4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2250 -3.1510 3.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -2.6930 2.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -0.1760 1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -1.4640 -1.2300 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3280 -1.3350 -1.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -1.1660 -2.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5710 -3.1360 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -3.8700 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -5.1790 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 -5.7640 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -5.0160 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -3.7100 -1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -7.1610 0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -7.8070 0.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -7.7880 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -0.2350 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -2.4820 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4300 -2.3100 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -2.8900 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -3.6510 5.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -3.3690 4.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 0.7460 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -0.9840 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -0.0380 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -3.4170 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -5.7510 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -5.4610 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -3.1320 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -7.0600 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -8.1040 0.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 -8.6530 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 11 1 0 0 0 0 4 5 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 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END