PUBCHEM-ZINC06180323 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 0.5500 1.7700 -0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4330 0.4230 -0.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -0.5410 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2930 -0.1170 -2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 -1.7640 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -2.8740 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -2.9450 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -2.0080 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -0.8780 -1.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 0.0540 -2.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2540 -0.1500 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4890 -3.9170 0.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2230 -3.4040 1.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -2.6370 2.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -3.9460 1.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -3.7330 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -2.8620 3.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -2.6990 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 -3.4030 4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -4.2750 3.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6910 -4.4550 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 -5.4120 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9300 -5.4970 0.6420 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5640 1.9900 -0.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 1.9840 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 2.4210 0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -1.4260 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 -2.1970 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -3.7460 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -2.2790 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.1560 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -1.0720 -2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 0.6860 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2020 -4.2650 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.7960 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -4.6250 1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3970 -2.2950 3.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -2.0200 5.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 -3.2740 5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 -4.8230 3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9970 -6.0460 1.4140 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 2 0 0 0 0 M CHG 1 23 -1 M END