PUBCHEM-ZINC05590983 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 2.0000 1.6790 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 0.2220 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -0.5770 -1.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2930 -2.0410 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -2.7030 -2.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 -4.0510 -2.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -4.8110 -1.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -6.1840 -1.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6390 -6.8090 -3.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -6.0630 -4.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -4.6750 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 -3.8830 -5.2790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6410 -2.8080 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -4.1030 -6.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -4.2190 -5.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -3.3860 -6.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -2.2930 -6.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -3.8720 -6.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4420 -5.2190 -6.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7450 -5.6410 -7.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8070 -4.7260 -7.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 -3.3780 -6.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2390 -2.9480 -6.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 -2.1410 -6.9700 S 0 0 0 0 0 0 0 0 0 0 0 0 9.3680 -2.2380 -8.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1610 -0.8980 -6.6710 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8980 -2.5670 -5.8330 N 0 5 0 0 0 0 0 0 0 0 0 0 10.3120 -3.4240 -6.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3700 -5.3640 -7.5980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 1.7680 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2970 2.1550 -1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 2.2320 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -0.2150 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 0.1700 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -0.1390 -2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -0.5200 -2.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 -2.4930 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -2.1030 -1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -4.3660 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -6.7630 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -7.8780 -3.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -6.5780 -5.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3130 -3.9030 -6.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -3.4350 -7.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -5.1260 -6.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 -5.0830 -5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -5.9490 -6.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9260 -6.6910 -7.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0320 -1.8980 -6.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 49 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 28 1 0 0 0 0 M CHG 1 27 -1 M END