PUBCHEM-ZINC05706219 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 2.6180 0.2250 6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -0.7310 5.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -1.0600 4.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0310 -0.4450 3.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5160 0.5200 4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 0.8510 6.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7480 -0.7950 2.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6750 0.0570 2.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 1.1480 2.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -0.5360 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9860 0.0190 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 1.3610 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6740 2.4840 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 3.5830 -0.2600 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7310 3.1900 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7560 1.7900 -0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9590 1.1180 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0910 1.8560 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0400 3.2440 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8640 3.9350 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 4.9440 -0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 5.2220 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3700 5.0050 -2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 -2.1450 0.7060 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5670 -2.0160 2.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -2.9570 2.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 0.4830 7.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -1.2210 5.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 -1.7910 3.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4650 1.0240 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 1.5980 6.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3030 -0.6110 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 2.6020 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0100 0.0340 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0160 1.3400 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9260 3.8040 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8330 5.0170 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 5.0650 0.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 5.6470 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 5.6780 -0.9260 O 0 5 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 21 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 40 -1 M END