PUBCHEM-ZINC02870731 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 0.5780 1.3680 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.0040 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -0.5430 0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 0.2890 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 1.6680 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 2.2050 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 2.5120 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0460 3.9570 0.8060 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 4.5080 0.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 4.6360 0.3830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8220 3.5940 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 3.3900 3.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 3.1060 4.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 3.0240 5.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 3.2290 4.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5460 3.5190 3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 2.7360 6.5560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 3.6120 7.4540 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 3.6340 6.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 3.1180 8.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 5.2730 7.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 6.1990 6.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 7.5020 6.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 7.8800 7.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 6.9540 8.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7280 5.6520 8.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 9.2750 7.6090 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7900 10.0900 6.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 9.6080 8.4430 O 0 5 0 0 0 0 0 0 0 0 0 0 4.7270 -0.3880 0.0330 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 1.7850 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.6560 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -1.6140 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 3.2760 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 2.2520 -0.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 3.4540 2.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6100 2.9470 5.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 3.1660 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6890 3.6830 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8020 2.0220 6.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5920 5.9040 5.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 8.2250 5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 7.2490 9.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 4.9300 9.1620 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 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 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END