PUBCHEM-ZINC02037580 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 1 0 0 0 0 0999 V2000 -1.0310 1.1580 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2140 -0.1420 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -0.3150 1.4250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6490 -0.7950 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -1.2880 2.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -1.5370 2.0860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0350 -0.7880 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 -1.5610 0.2610 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -2.8580 2.8570 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0980 -3.7700 2.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -2.2400 3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -2.5350 3.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0000 -3.0630 4.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -3.5480 3.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -3.7920 2.8920 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -3.7770 5.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -2.5600 5.5060 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.0200 -3.1470 7.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5330 -4.4440 7.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 -4.8810 8.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1280 -4.0200 9.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6380 -2.7200 9.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -2.2830 8.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 1.0150 2.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 1.3210 3.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -0.2960 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 2.0310 0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 1.1740 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6210 1.3000 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -2.8430 4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -4.7980 5.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2710 -3.6900 6.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 -5.1230 6.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4750 -5.8900 8.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5550 -4.3600 10.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6850 -2.0460 10.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 -1.2650 8.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 0.4970 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -1.2550 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -0.2330 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 1.6590 1.5460 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 24 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 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 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 41 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M CHG 1 41 -1 M END