PUBCHEM-ZINC06036362 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.8800 1.5480 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 0.1170 0.1450 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1830 -0.5740 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -0.1400 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -0.0490 2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.4510 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -0.3690 5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.8060 6.4280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9550 -1.7880 6.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -0.6310 7.8090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1460 -0.1230 7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 0.3520 8.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 1.0610 8.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 0.1880 6.7780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -1.8560 8.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7020 -1.4980 9.9650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -2.2890 10.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -0.1830 -1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.0880 -2.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.8530 -3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.0920 -4.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 1.4310 -4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4290 1.7620 -6.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 2.3820 -6.9310 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5810 0.9540 -5.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 -1.1250 -2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 2.2840 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 1.7260 -0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5520 1.7450 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -1.1430 1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 0.5680 1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7060 0.9730 2.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -0.7030 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -1.4730 3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3650 0.2020 4.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 0.6530 5.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -1.0220 5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -2.6340 8.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.2680 8.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4230 0.4890 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -1.1970 -1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 1.5270 -3.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 1.4840 -3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 0.1140 -5.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 0.7470 -6.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 1.8650 -5.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -0.8940 -2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -1.2070 -3.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 -2.1150 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6410 1.4000 -6.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 18 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 50 2 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 M CHG 1 24 -1 M END