PUBCHEM-ZINC05161855 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 52 0 0 1 0 0 0 0 0999 V2000 0.0320 1.4480 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 0.0480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.7210 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 0.0130 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 1.4140 -0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 2.1440 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 3.6480 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 4.1070 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 5.6280 1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 6.0700 2.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5940 5.2730 3.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 7.4160 3.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0350 8.4590 2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 9.7210 2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8570 9.4810 4.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 7.9690 4.4870 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9310 7.7330 5.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 7.5130 5.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 7.1830 4.6200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -2.1120 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4230 -2.9080 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0890 -2.9800 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 -3.9650 1.2240 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0670 -2.8770 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -3.0840 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2380 -4.0270 -1.0460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 1.9890 0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -0.4170 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -0.4810 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3640 1.9250 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 4.0330 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3520 4.0510 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 3.6980 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 3.7020 1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 6.0390 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 6.0330 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 8.2730 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 8.4900 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 9.8070 2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 10.6280 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3920 10.0600 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1940 9.7950 4.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -3.9280 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -2.5270 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3690 -1.9910 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -3.4400 2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -3.8600 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -2.4060 0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -2.1350 -1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -3.6310 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 7.5790 6.5530 O 0 5 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 20 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 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 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 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 51 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 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 M CHG 1 51 -1 M END