SIAL-ZINC04799554 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.4860 1.5430 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.1080 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 0.0900 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 -0.8210 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -0.3320 -1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 0.4370 -2.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -1.6330 -1.4390 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 -2.3330 -2.6030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5850 -1.8260 -2.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -2.2310 -3.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 -3.0040 -3.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -4.4670 -3.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -4.6640 -2.1640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0500 -4.4010 -1.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9140 -3.8230 -2.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5510 -4.2510 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6730 -3.8600 -0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -3.4450 0.0470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 -6.0680 -2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -6.6430 -0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 2.2480 -0.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2760 1.6060 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 1.8870 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 0.4910 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -0.9220 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 0.6940 0.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.8770 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -1.8430 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5750 -0.4650 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 -2.1890 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -1.1920 -4.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -2.6370 -4.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -2.5690 -2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1540 -2.9250 -4.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -5.0070 -3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -4.9360 -4.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -6.4860 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -7.7200 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -6.2430 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8650 -4.2650 -1.0090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 19 20 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 M CHG 1 40 -1 M END