SIAL-ZINC04523132 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 0.3880 0.9840 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.0290 0.2590 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.4820 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.5390 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -0.2950 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 -0.5780 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0820 -1.1960 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3970 -1.3470 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6520 -2.0870 -1.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9020 -2.6050 -2.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0990 -3.2740 -3.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0720 -3.4400 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 -2.8850 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6290 -2.2380 -2.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3890 -1.6870 -2.5260 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 -1.8130 -1.1680 C 0 5 0 0 0 0 0 0 0 0 0 0 -1.6560 -1.2630 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2750 -4.1100 -5.5290 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5840 -4.6340 -5.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1730 -4.3090 -6.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4460 -0.6660 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 0.7450 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4180 1.5220 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3660 0.8690 1.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3590 -0.5250 1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4010 -1.3080 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 -2.8000 1.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 -3.3900 1.7270 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.3740 2.9190 0.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 3.6990 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8170 4.8360 2.6810 S 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 1.4860 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 1.7680 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 0.5230 2.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -0.2130 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -1.5730 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1030 -0.0300 -1.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9390 0.1220 2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -0.3750 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7510 -2.5150 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0940 -3.6690 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9760 -2.9410 -4.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -1.4990 -1.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9090 -5.3970 -5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3290 -3.8310 -5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5780 -5.1060 -6.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -4.8700 -5.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4810 -4.8820 -7.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -3.3490 -6.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7650 1.2510 -0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1270 1.4280 2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1120 -1.0210 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6030 -3.3370 0.9820 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 17 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 16 1 0 0 0 0 8 9 1 0 0 0 0 8 21 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 29 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 2 0 0 0 0 29 30 2 0 0 0 0 30 31 2 0 0 0 0 M CHG 1 16 -1 M CHG 1 28 -1 M END