SIAL-ZINC04652318 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 1.0110 2.0100 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 0.6080 -0.1210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -0.1900 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 0.2470 -2.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -0.6710 -3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -2.0370 -3.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1070 -2.4870 -2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8970 -1.5580 -0.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -3.8810 -1.8500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.5880 -0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 -4.0870 0.3670 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -5.9410 -1.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -7.0300 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -6.8870 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 -8.0100 1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 -9.2820 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -9.4350 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -8.3190 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -8.5000 -2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -7.4280 -2.8490 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7010 -3.0230 -4.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 -2.6210 -5.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 2.2560 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 2.3980 -1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 2.4950 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 1.2990 -2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -0.2850 -4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.8710 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -4.4200 -2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -6.2660 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 -5.9130 1.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -7.8880 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 -10.1550 1.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -10.4320 -0.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -3.5220 -6.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -1.9730 -5.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -2.1370 -5.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 -9.6800 -2.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 7 2 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 2 0 0 0 0 21 22 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 20 -1 M END