PUBCHEM-ZINC02556391 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 44 0 0 0 0 0 0 0 0999 V2000 -0.4910 1.0840 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.1680 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -0.5340 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 0.2200 2.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -0.3980 3.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 0.3360 4.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 1.1540 4.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 1.9090 5.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8170 3.3270 5.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 4.0810 7.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 4.4490 8.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2830 5.1960 9.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 4.6220 10.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 5.4790 11.7410 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 5.6490 12.3030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 4.4160 7.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.0650 5.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.0360 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 1.6330 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 1.7580 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 0.8360 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -1.4770 1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 0.1890 3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 1.2820 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -0.4080 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -1.4510 3.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6640 1.2970 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 1.9540 5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 1.3580 6.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 3.2700 5.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 3.9030 5.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 4.1910 7.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 6.2460 9.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2920 5.1350 9.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1530 3.5230 7.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 5.1820 8.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 4.8060 6.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0800 0.3060 5.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.6500 6.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -0.9940 5.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -0.4790 -1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -1.9340 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 -1.3620 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 4.5940 12.5810 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4880 6.7780 11.2720 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 2 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 17 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 M CHG 1 44 -1 M CHG 1 45 -1 M END