SIAL-ZINC04514038 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 1.0020 1.6630 -1.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 0.4390 -1.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -0.3590 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 0.1350 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5650 1.4150 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 2.2330 -1.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 1.6430 0.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7880 0.5120 1.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -0.4230 1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4260 2.8510 0.7390 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1110 3.5180 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 3.5520 2.1240 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4760 2.7770 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8080 4.2180 2.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2020 4.4480 3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6680 3.1940 1.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0350 2.4570 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7930 2.4800 0.4520 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 3.8200 0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9640 2.5280 -0.0470 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9250 3.5480 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7340 2.6650 -2.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 10.1170 2.1290 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7670 3.5840 -2.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9390 3.2110 -2.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 5.4570 1.3780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 5.6340 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4990 4.5050 2.1730 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4970 -1.6150 -0.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 2.2660 -2.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 0.4280 2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4270 4.3620 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3910 4.5060 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2390 4.1710 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5730 4.2140 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -1.9020 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.2130 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3430 4.5000 -3.5910 O 0 5 0 0 0 0 0 0 0 0 0 0 11.5240 1.6210 -1.3940 N 0 3 0 0 0 0 0 0 0 0 0 0 11.4820 0.6940 -1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2590 1.5910 -0.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5100 1.9970 -1.5270 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 30 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 39 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 26 27 1 0 0 0 0 29 36 1 0 0 0 0 29 37 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 39 42 1 0 0 0 0 M CHG 1 28 -1 M CHG 1 38 -1 M CHG 1 39 1 M END