PUBCHEM-ZINC05885053 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -0.0080 1.1550 S 0 0 0 0 0 0 0 0 0 0 0 0 3.0390 -0.5720 2.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -1.1680 3.5430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9550 0.0480 2.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.6090 4.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.4490 5.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 -0.8150 4.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -0.6560 4.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -0.3900 3.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 -2.2860 5.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -1.2430 6.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -0.8980 7.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 0.0640 8.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 0.6850 7.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 0.3560 6.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 -0.6180 5.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.9440 4.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.3180 4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 0.6440 4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 0.9760 6.0730 C 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 -2.3980 2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -1.8040 6.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -2.8660 5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -2.9480 6.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -1.3770 8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 0.3190 9.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0710 1.4280 8.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -1.6870 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 -0.5700 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4060 1.1260 4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 1.7230 6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END