PUBCHEM-ZINC05573492 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -1.1370 2.3180 -0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 0.8230 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 0.4060 -1.9150 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2750 0.3910 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 0.6910 -1.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 0.0140 -3.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4390 -0.4470 -4.0160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3420 0.0060 -5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 0.0040 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 0.0050 -3.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -2.2150 -4.2070 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -2.5710 -4.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -2.7990 -2.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 -2.5270 -5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -4.0190 -5.4080 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4340 -4.4650 -4.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2970 -4.7700 -6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -4.1590 -6.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0010 -3.3710 -7.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -5.2230 -5.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1970 -6.3000 -4.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -7.4280 -5.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 -6.6990 -5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8530 -5.3830 -6.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7500 -5.4480 -7.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9040 -4.3010 -5.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6620 -3.6140 -4.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 2.8880 -0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 2.6010 -1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 2.6140 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 0.5660 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8150 0.2780 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 0.9130 -3.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 -0.7450 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -2.0270 -4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -2.0460 -6.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -4.8960 -5.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -5.7700 -6.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -4.2380 -7.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 -6.5830 -4.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4550 -5.9560 -3.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -7.9480 -6.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2920 -8.1630 -4.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9420 -7.2830 -6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 -6.5290 -4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9150 -4.2680 -6.7390 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 M CHG 1 46 -1 M END