PUBCHEM-ZINC02467334 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 4.2600 2.6810 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 2.6980 5.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9520 3.9010 6.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 5.0910 5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8850 5.0790 4.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 3.8700 3.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 3.8580 1.9580 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 5.1430 1.3450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 2.6330 1.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 3.7360 2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 4.4000 1.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 5.0640 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 2.5320 3.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 2.6280 4.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 1.3350 2.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 0.1430 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9790 -0.5110 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 0.4910 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 1.1280 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -1.6370 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -2.3200 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -3.2020 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -2.4190 -1.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 -1.7210 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2240 -0.8320 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 3.9170 7.6390 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 1.7400 3.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2270 1.7750 5.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5700 6.0280 6.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 6.0110 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 4.8580 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 3.9910 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 5.0750 3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 5.9780 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -0.5550 3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 0.3800 4.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -1.4660 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 0.1500 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 1.1650 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 0.2420 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 2.0570 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 0.4620 0.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -2.4240 1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 -1.5780 -1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -2.9340 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 -3.6280 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -4.0440 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7510 -1.6700 -2.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -3.0960 -1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 -1.1170 -0.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6140 -2.4740 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -0.3970 1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -0.0040 -0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 -0.7960 1.0470 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0350 -1.3910 0.9770 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 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 26 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 54 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 1 0 0 0 0 20 43 1 0 0 0 0 20 54 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END