PUBCHEM-ZINC05976041 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -3.5370 -0.9320 0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7810 -1.9360 0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -2.0300 2.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -1.2270 3.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1050 0.0780 4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0240 0.2160 5.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -2.6440 1.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.1040 1.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -2.1950 2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -1.6040 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -1.1780 0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -1.4730 0.3990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -1.1550 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 0.3550 -0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3330 2.1810 -2.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 2.4780 -3.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 2.0720 -3.9760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 0.6650 -3.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 0.2660 -2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -0.9490 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -0.0890 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -2.7730 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 -1.3830 2.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3690 -3.0540 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -1.1280 3.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -2.0610 4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 0.9750 3.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -0.6330 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4060 1.1970 5.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3230 -3.0700 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -3.4530 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -2.6580 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7160 -1.5200 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7010 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -1.6050 -1.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.6480 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 0.7950 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 0.8610 -0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 2.4310 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 2.7110 -1.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 3.5540 -4.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 1.9770 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 0.4170 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 0.1250 -4.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 0.7780 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -0.8180 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -1.6060 2.4230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.7220 -0.7550 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 0.6850 -2.2960 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7350 0.1930 -3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 47 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 19 49 1 0 0 0 0 47 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 47 1 M CHG 1 49 1 M END