SIAL-ZINC04514036 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 0.5470 1.6250 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 0.2910 1.3740 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 -0.3520 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 0.4030 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 1.7580 0.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5250 2.4420 0.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 2.2340 0.0160 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7290 1.1840 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 0.0590 0.4070 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1040 3.5970 -0.4020 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2630 4.2040 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 3.9060 -1.9240 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7120 4.8110 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7800 4.3570 -1.9540 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9980 5.0680 -2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 4.9530 -0.5720 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5050 5.9400 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 4.0770 0.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4500 5.0270 -0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 5.9980 1.3740 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4310 5.7950 1.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8470 4.3500 1.9050 C 0 0 3 0 0 0 0 0 0 0 0 0 9.9020 3.7420 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2080 4.4110 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0730 3.9630 3.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 3.2010 -2.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 2.6180 -2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 2.8490 -2.7190 O 0 5 0 0 0 0 0 0 0 0 0 0 1.8320 -1.7120 1.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 2.0970 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7520 1.3000 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8370 4.0210 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0420 5.5140 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9670 6.2010 0.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6880 6.4350 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.1880 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -2.1980 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1880 4.8680 1.9940 O 0 5 0 0 0 0 0 0 0 0 0 0 8.8710 3.6690 2.8410 N 0 3 0 0 0 0 0 0 0 0 0 0 8.6720 2.7000 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0020 4.1990 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4490 3.6370 3.7270 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