SIAL-ZINC04514042 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.3270 1.1490 0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -0.1610 0.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.6150 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 0.3010 0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4800 1.6110 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 2.1090 0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 2.2700 -0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6700 1.3620 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 0.1610 0.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 3.6670 -0.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8100 4.1460 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 3.9290 -1.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3130 3.2850 -1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 5.3540 -1.5350 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1260 6.0960 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4760 5.2850 -0.1060 C 0 0 3 0 0 0 0 0 0 0 0 0 5.3370 6.2530 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6610 4.3030 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9490 4.8760 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 4.8750 1.6760 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2650 4.2920 1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0220 3.9760 2.6080 C 0 0 3 0 0 0 0 0 0 0 0 0 9.7240 3.0340 3.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5030 4.0080 2.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0360 5.0710 2.6570 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9030 5.7120 -2.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 5.3310 -3.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5350 3.9560 -2.7530 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0400 -1.9500 1.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 1.4710 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 1.6330 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 3.8650 -0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5680 5.5720 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2110 3.3910 0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7670 5.0710 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -2.5450 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -2.2970 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9450 3.0630 1.4980 O 0 5 0 0 0 0 0 0 0 0 0 0 9.8270 5.0770 3.6330 N 0 3 0 0 0 0 0 0 0 0 0 0 9.8150 4.7360 4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0110 5.6640 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7310 5.6120 3.5000 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 30 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 39 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 26 27 1 0 0 0 0 29 36 1 0 0 0 0 29 37 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 38 -1 M CHG 1 39 1 M END