PUBCHEM-ZINC05709567 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 32 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -1.8010 -1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -2.5480 -0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3610 -2.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4570 -4.1730 -2.4960 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3380 -4.6170 -1.4740 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 -4.6400 -3.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -4.9120 -3.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3130 -5.2770 -5.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -5.3710 -6.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 -5.0970 -6.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -4.7380 -5.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -4.4520 -5.1920 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4720 -4.5380 -6.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -4.1300 -4.1690 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4540 -5.8360 -7.7720 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1620 -6.0760 -7.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1970 -7.0770 -6.2360 F 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -6.4550 -8.2970 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6480 -4.8800 -6.6710 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9610 -2.0270 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -2.0110 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -4.8390 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3710 -5.4890 -5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -5.1690 -7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 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 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END