PUBCHEM-ZINC04774524 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 57 0 0 1 0 0 0 0 0999 V2000 0.8250 1.5010 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.1210 -0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -0.6380 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 -0.0180 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 1.3620 0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0190 2.1210 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0960 3.6260 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7080 4.1910 1.8990 S 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 5.9320 1.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 6.8120 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 6.6560 4.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 5.5670 4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 5.8060 6.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 7.0390 6.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 8.0900 5.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 7.9520 4.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 8.8490 3.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 8.1910 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1230 8.6050 1.3020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3170 7.7440 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 6.4410 0.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5770 10.3030 3.8750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6500 10.6600 4.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 10.7060 4.7450 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0970 9.8740 5.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 11.0450 3.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7460 10.3810 3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2160 10.8070 2.3490 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4350 9.8020 1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 10.9520 2.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 11.8510 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1430 11.5450 0.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2960 12.4090 3.8490 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 11.8500 5.5420 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 4.2720 4.5100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -2.1150 0.0230 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7500 -2.6620 -0.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7920 -2.7840 0.2590 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0520 2.0940 -0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -0.3630 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -0.6110 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 1.8470 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 3.9480 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 4.0510 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 7.1910 7.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 8.1190 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 12.8390 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 11.8400 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 12.1670 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 12.6760 3.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 12.1460 6.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 3.9920 3.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 3.6450 4.7350 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 21 2 0 0 0 0 10 11 1 0 0 0 0 10 18 2 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 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 34 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 33 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 31 32 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 33 50 1 0 0 0 0 34 51 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 36 1 M CHG 1 38 -1 M END