PUBCHEM-ZINC03632217 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.1800 1.4720 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.0350 -0.0200 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6310 -0.6890 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -0.6690 2.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 -1.2650 0.6970 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -1.0880 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8000 -1.4680 -1.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -0.3780 -1.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -1.9660 1.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -3.4430 1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4190 -4.2020 2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3580 -3.5250 3.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -0.6760 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 -1.6190 0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -1.9760 -0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -1.2940 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -0.2380 -1.6880 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 1.8810 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 2.0050 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 1.7180 1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.1450 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -1.8370 1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -1.4950 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -3.5670 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -3.9060 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -2.0450 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -2.6970 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5020 -1.3680 -1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -5.4380 2.6240 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 11 29 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 26 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 M CHG 1 29 -1 M END