PUBCHEM-ZINC02954821 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0140 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 1.3940 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 3.5590 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2980 4.2190 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 5.5880 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 6.2920 0.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 7.6710 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 8.3570 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 7.6660 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 6.2870 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 10.1190 0.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 10.5130 -0.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 10.5170 1.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3560 10.6250 -1.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 10.8510 -2.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 12.2660 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 12.4440 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 12.2710 -1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7560 10.8610 -0.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.1630 -0.0210 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1690 -2.7800 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -2.7640 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5220 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3340 1.9370 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 4.0920 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 5.7570 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 8.2160 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 8.2080 -1.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 5.7490 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 10.1220 -3.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 10.7500 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 12.4120 -3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 12.9950 -2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4270 11.6980 -3.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 13.4420 -2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2190 12.4220 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5790 13.0010 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 10.7680 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3960 10.1340 -1.2120 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 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 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END