SIAL-ZINC04533731 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 1 0 0 0 0 0999 V2000 0.1270 1.2790 0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -0.0310 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -0.7540 0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 -0.1570 0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 1.1560 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 1.8800 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3430 3.2710 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3380 3.6580 -1.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 4.1200 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 5.8770 -0.3400 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8240 6.5970 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 8.1240 -0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.4130 8.3990 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2470 8.6260 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 8.7880 -1.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8910 8.7830 0.7910 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 9.1870 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 9.1320 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8560 8.7960 3.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 8.7880 -1.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 9.8790 -1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 10.3810 0.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 10.4100 -2.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 11.6200 -1.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 12.2080 -3.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5450 11.4520 -3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 13.3860 -2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 14.3980 -3.5840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -2.0610 1.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -2.8040 1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -3.9120 1.8620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8050 1.8240 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -0.4770 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 -0.7070 0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5060 1.5780 -0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 3.8220 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2360 3.9840 -1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4420 6.1510 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 6.3180 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4440 8.6230 1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9010 8.5200 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3840 10.2070 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 8.4370 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 10.6720 -3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 9.6040 -2.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 11.3170 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 12.3920 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -4.6320 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9780 9.4180 2.5890 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.9270 13.2080 -2.1150 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0540 12.7870 -4.1240 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0980 12.3660 -5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 12.9330 -3.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 13.7670 -4.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -2.5060 1.4890 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 29 30 1 0 0 0 0 29 55 1 0 0 0 0 30 31 2 0 0 0 0 31 48 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 M CHG 1 49 -1 M CHG 1 50 -1 M CHG 1 51 1 M END