IBS-ZINC04089172 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 1 0 0 0 0 0999 V2000 0.0480 1.4050 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1020 -0.1120 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -0.4950 -0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -0.0210 0.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 1.8680 0.0520 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0380 1.3450 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 3.3810 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1490 3.9790 -0.8570 P 0 0 3 0 0 0 0 0 0 0 0 0 3.6990 3.3030 -2.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9960 5.7630 -1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 3.9620 0.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0620 3.0450 0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 1.6200 1.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 1.0480 2.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 1.8660 -0.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.7570 0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -0.5030 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -0.6040 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 3.6410 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 3.9510 0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 5.9910 -2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 6.1790 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -1.2540 -1.4420 O 0 5 0 0 0 0 0 0 0 0 0 0 4.2740 6.5490 -1.1030 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1270 7.5630 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8340 6.3060 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8320 6.2620 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 2.0810 1.2960 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 2 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 M CHG 1 23 -1 M CHG 1 24 1 M CHG 1 28 -1 M END