PUBCHEM-ZINC06269856 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6750 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0300 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 1.4080 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0810 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 2.2170 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8380 1.3380 0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 0.1100 -0.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6940 -0.7470 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0230 -0.5740 -0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -1.0240 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6890 -1.7000 0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4300 -1.9290 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 -1.4820 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7670 -0.8100 -1.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2730 -0.3370 -2.8150 N 0 3 0 0 0 0 0 0 0 0 0 0 6.9260 -0.5450 -3.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2140 0.2590 -2.8880 O 0 5 0 0 0 0 0 0 0 0 0 0 9.9630 -2.7910 -0.0900 S 0 0 0 0 0 0 0 0 0 0 0 0 10.7200 -2.4020 -1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4260 -2.6290 1.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6330 -4.4030 -0.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6320 -5.0160 -1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5680 -6.2290 -1.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1530 -7.1760 -0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2750 -6.4560 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3410 -5.2480 0.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -0.5580 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -1.7550 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 3.1610 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 2.6080 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5650 3.0480 0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7710 1.8720 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7580 1.0800 1.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8870 -1.1260 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6070 -1.5860 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 -0.8460 1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0510 -2.0500 1.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5520 -1.6620 -2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6210 -5.3380 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9820 -4.2920 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5030 -6.7490 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5930 -5.8950 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 -7.4900 -0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8030 -8.0520 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0020 -7.1390 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3030 -6.1200 1.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 -4.6760 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3070 -5.5880 0.8430 H 0 0 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 14 20 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END