PUBCHEM-ZINC00180268 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.1950 1.6900 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2610 0.1880 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -0.4090 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 -1.7830 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 -2.5760 0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 -1.9740 -1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -0.5920 -1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 0.0170 -2.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -0.6450 -3.7440 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 0.2690 -4.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 -2.0040 -3.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -0.6600 -3.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 0.4230 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6330 0.4110 -3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -0.6840 -2.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -1.7670 -2.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0810 -1.7570 -2.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6750 -0.6960 -2.6990 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.3590 0.2590 -3.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1910 -1.6600 -2.1630 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4460 -4.0480 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 -4.7360 -0.7050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 2.0150 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 2.0040 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 2.1370 0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 0.2020 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5860 -2.2460 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -2.5820 -1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 0.8280 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8150 1.2780 -4.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 1.2580 -3.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -2.6220 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -2.6040 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -4.6280 1.5010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -5.5940 1.5220 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 2 0 0 0 0 21 34 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END