PUBCHEM-ZINC05829950 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 30 0 0 1 0 0 0 0 0999 V2000 0.0230 1.5400 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 0.0780 -0.3490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7550 0.0170 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 -0.6710 -0.4260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9630 -0.0190 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -1.2760 0.9590 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8990 -2.1640 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -1.6290 1.2710 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4530 -2.5680 0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -0.6100 0.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -1.7210 2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -2.8330 3.1030 P 0 0 0 0 0 0 0 0 0 0 0 0 3.2430 -2.5560 2.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 -0.3000 1.8360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -0.6790 2.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -1.7230 -1.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9500 -2.0460 -1.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 2.3110 -0.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 3.9280 -0.0850 P 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 4.0100 1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 1.9520 -0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 1.6310 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -0.7340 3.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -2.1130 3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -2.9910 4.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -4.2840 2.6700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 4.4870 -0.7590 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2490 4.3790 -0.7330 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0060 -4.9910 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -3.4900 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 16 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 12 26 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 27 1 0 0 0 0 19 28 1 0 0 0 0 25 30 1 0 0 0 0 26 29 1 0 0 0 0 M CHG 1 27 -1 M CHG 1 28 -1 M END