PUBCHEM-ZINC05731137 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3770 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 1.2120 -0.6820 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0270 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.4080 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 2.0870 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 3.4860 0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 4.3220 1.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 4.1200 2.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7820 6.0040 0.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 6.6490 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 7.9680 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 8.6440 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 7.9990 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 6.6810 -0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 10.0560 -0.1830 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0310 10.6240 0.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 10.6510 -1.0570 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2300 -2.0410 -0.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9040 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 3.3460 -0.5010 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 1.9600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 3.9670 -0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 6.1210 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 8.4720 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 8.5260 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2490 6.1790 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.4300 -0.9060 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 29 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M END