PUBCHEM-ZINC06096500 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 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 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1690 -0.0010 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -1.5750 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6330 -2.7710 -1.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 -0.8040 -1.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8340 -1.3630 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9530 -2.5590 -1.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 -0.5020 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4760 -0.5350 -1.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 11.2750 0.2780 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8980 0.0460 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2730 -1.0170 -3.2880 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5990 -1.4150 -0.5070 C 0 0 3 0 0 0 0 0 0 0 0 0 13.4730 -0.7980 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1370 -2.0840 0.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4280 -1.5160 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0040 -2.1300 3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2880 -3.3110 3.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9970 -3.8780 1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4170 -3.2620 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8350 -3.9680 4.3360 N 0 3 0 0 0 0 0 0 0 0 0 0 11.0930 -3.4690 5.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2050 -5.0090 4.2810 O 0 5 0 0 0 0 0 0 0 0 0 0 12.9420 -2.4110 -1.4730 O 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 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5130 0.1520 -1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0980 0.2430 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0090 0.0000 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0660 0.6000 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7460 0.7160 -2.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5530 -0.7220 -4.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9870 -0.5930 2.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2320 -1.6860 4.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4380 -4.8010 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1860 -3.7040 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2100 -2.9970 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -2.7400 -1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2610 -1.3420 -1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2180 -2.0820 -0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -1.8530 -2.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -1.4290 -2.1950 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 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 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 53 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 15 51 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 16 51 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 31 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 31 49 1 0 0 0 0 50 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 28 1 M CHG 1 30 -1 M END