IBS-ZINC02161032 MOE2007 3D CORINA 3.40 0006 02.08.2006 25 24 0 0 1 0 0 0 0 0999 V2000 0.2160 1.4670 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -0.0530 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7200 -0.4320 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.5140 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -0.1480 -1.8260 P 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -0.7980 -2.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -1.1220 -1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -0.9160 -2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5160 1.2910 -1.8950 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6970 -0.5850 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1260 -1.0610 2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 1.7900 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.9070 -0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 1.8940 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 -1.6040 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.0860 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 -2.1780 -1.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -0.7900 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 0.1260 -3.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -1.2510 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 -1.7230 -2.9160 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.2020 -1.5980 -3.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1940 -1.4460 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4050 -2.7210 -2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 -0.4920 1.4260 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 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 15 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 0 0 0 8 21 1 0 0 0 0 10 11 2 0 0 0 0 10 25 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 M CHG 1 9 -1 M CHG 1 21 1 M CHG 1 25 -1 M END