IBS-ZINC06659584 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5540 -1.7260 -0.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2830 -0.7430 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -1.8730 2.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5860 -2.7820 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1220 -1.4870 3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6270 -2.1710 4.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0260 -1.4680 5.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -0.0850 5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 0.6040 4.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 -0.0860 3.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 0.3020 2.0990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -0.0180 -0.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -0.2800 -2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8420 -1.0890 -2.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 0.4090 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6480 0.2300 -4.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 1.0060 -5.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 1.7930 -4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 1.6050 -2.6520 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7060 -3.2480 4.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4190 -1.9990 6.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2420 0.4530 6.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3570 1.6810 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 0.6260 -0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -0.4530 -5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8060 0.9810 -6.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0950 2.4620 -4.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 1 0 0 0 0 10 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 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 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 1 0 0 0 0 19 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 22 23 2 0 0 0 0 22 26 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 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 M END