SIAL-ZINC04786817 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 0.0050 1.2570 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -0.1230 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -0.7330 -0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 0.0110 0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3880 1.3910 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.0370 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 3.4230 0.5750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 4.2690 0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 5.6150 0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0560 6.3790 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 5.9080 1.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 4.6020 1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 3.7580 1.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 6.1640 -0.2350 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -2.5170 -0.2650 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -2.8390 0.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -3.0090 0.5670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 -2.7580 -1.8260 N 0 5 0 0 0 0 0 0 0 0 0 0 2.0570 -2.3340 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 1.7130 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7870 -0.7130 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -0.4690 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 1.9580 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9690 3.8990 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 7.4360 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 4.1880 2.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 5.5640 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 7.1650 -0.3470 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 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 18 1 0 0 0 0 18 19 1 0 0 0 0 M CHG 1 18 -1 M END