SIAL-ZINC04533486 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 39 0 0 1 0 0 0 0 0999 V2000 0.1130 1.2250 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.1550 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 -0.4400 0.7060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0910 -1.6770 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -1.7520 0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -0.5430 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 0.7310 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 0.7640 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 1.7930 0.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3870 1.7060 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4930 1.0320 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3050 -0.3310 -0.2400 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2970 -1.3690 -0.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9530 -2.2380 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6980 -1.7790 -1.7900 C 0 0 3 0 0 0 0 0 0 0 0 0 7.0610 -2.8160 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 -0.8240 -2.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 7.4440 0.1890 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5860 -0.8460 -0.7980 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1210 0.0950 -0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5480 -0.9320 0.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5490 -2.0120 -0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0720 -1.9510 0.7200 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3060 -1.7430 1.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3260 -1.3270 -3.3060 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 -1.7330 -4.2130 P 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -3.1650 -4.6560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9030 -1.6830 -2.9480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 1.8420 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -0.9180 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.6180 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 1.4810 -0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0550 -2.9830 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3820 -1.9640 -1.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -0.6020 -5.1610 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 9 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 12 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 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 21 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 26 35 1 0 0 0 0 M CHG 1 35 -1 M END