SIAL-ZINC04517585 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 1 0 0 0 0 0999 V2000 0.2000 1.1480 -1.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.1780 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -0.7960 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 -0.0140 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4920 1.3200 -0.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 1.8920 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 3.2810 -1.6190 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4990 3.6840 -2.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 3.9770 -1.2420 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6360 -0.5860 0.4410 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5260 -1.3320 1.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7110 -0.2660 -0.0880 O 0 5 0 0 0 0 0 0 0 0 0 0 1.1950 -2.1030 0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -3.1200 -0.1370 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8020 -2.6940 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.0090 -1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -3.3270 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -4.2590 -3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -5.2330 -3.6720 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3650 -3.9090 -5.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -4.4910 -5.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -3.0990 -5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.0760 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -4.3060 1.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 1.5750 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -0.7180 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 1.8910 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -2.4570 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6980 -4.3150 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.9380 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -2.9870 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -2.4540 -2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -4.5090 1.3020 O 0 5 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 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 13 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 27 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 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 2 0 0 0 0 23 33 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M CHG 1 33 -1 M END