IBS-ZINC05163886 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 0.0490 2.0850 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 0.5640 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -0.0980 1.2660 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2540 0.2900 2.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -1.6120 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 0.1960 1.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 0.1760 2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2830 -0.1100 3.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9910 -0.1380 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 0.1380 4.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 0.4350 3.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1550 0.4390 2.2580 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 0.7170 3.2460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9640 -0.2740 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4720 -0.0170 2.4380 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8350 -0.1130 3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7550 1.3980 1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9920 2.4070 2.7880 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3480 2.3500 3.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4980 2.0800 2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2220 3.8190 2.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1830 -1.0360 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 0.1180 5.8080 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7190 -0.9140 6.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 1.1330 6.4670 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3790 -0.4390 5.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 2.3760 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 2.5570 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 2.4060 1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 0.2730 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 0.2440 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -2.0000 0.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -2.0840 2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -1.8310 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 0.4040 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7570 -1.2750 2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6030 -0.1910 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8240 1.6000 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4270 1.4820 0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 2.1520 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9530 2.7880 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8650 3.8770 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6790 4.5370 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2870 4.0500 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8200 -0.9390 0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2570 -0.8530 1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 -2.0430 1.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4290 -0.6300 5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9020 -0.4580 6.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 23 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END