SIAL-ZINC02506164 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 3.5920 0.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1180 3.9420 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8770 4.1050 1.2560 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9090 3.7560 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 5.6120 1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 6.2020 1.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 4.1110 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 3.3360 -2.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 -2.1590 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1820 -2.7820 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2910 -2.7540 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4990 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 3.8720 3.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 6.3000 0.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 3.6000 2.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 3.9100 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 5.4330 -1.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 5.7180 -2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 7.2640 0.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 23 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 22 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 26 27 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END