IBS-ZINC03945117 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3620 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 1.2220 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 0.0280 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 1.3940 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0770 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 3.5500 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 4.2140 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 5.6150 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4410 6.3160 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 7.6780 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 8.1600 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 8.3450 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6240 9.5640 0.0080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 7.5900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 6.2790 -0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5910 5.6660 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -2.1620 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -2.7830 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.8890 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 3.3660 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 1.9460 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 4.0770 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 6.0890 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 8.0860 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -2.8200 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -3.7860 -0.0380 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 1 0 0 0 0 10 17 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 27 28 1 0 0 0 0 M END