PUBCHEM-ZINC02869156 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.4240 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0050 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6070 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 0.1600 2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4540 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8330 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -2.6060 2.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -1.9970 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -2.7780 0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -3.2820 0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -2.2300 -0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 -1.1640 -0.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -2.4740 -0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4970 -1.4640 -0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1320 -0.1320 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0370 0.8680 -0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3130 0.5530 -0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -0.7630 -1.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7860 -1.7870 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -3.1970 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4270 -4.0840 -0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3860 -3.5020 -1.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7100 -4.9110 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -3.1300 -1.2830 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -3.2570 -2.2830 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -2.1120 -1.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -4.7380 -0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -2.4840 4.2980 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0900 -1.8050 5.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6300 -3.7000 4.3640 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0060 1.8010 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 1.7750 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 1.7870 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.2380 1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 0.1460 3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -3.6840 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -4.1810 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 -3.5200 1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9030 -3.3540 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 0.1230 0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7490 1.9030 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0130 1.3430 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6880 -1.0040 -1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9770 -5.3950 -2.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6940 -5.3790 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7030 -5.0170 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -5.4380 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1570 -5.1210 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -4.6210 -0.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END