SIAL-ZINC04543453 MOE2007 3D CORINA 3.40 0006 02.08.2006 66 71 0 0 1 0 0 0 0 0999 V2000 -0.0150 1.2960 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -0.0040 0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -0.4350 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -1.7110 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.7260 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -1.7750 -0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6870 -2.6390 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9900 -0.6330 -0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 0.5580 -0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 0.7000 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 1.7770 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 3.1870 0.0030 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5130 3.3390 0.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 3.6560 -1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 4.2850 -1.9370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3080 3.7480 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 4.1230 -0.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8930 3.2170 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 4.0190 0.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 5.3470 -0.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 5.1270 0.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 6.2110 0.7780 P 0 0 3 0 0 0 0 0 0 0 0 0 -2.6540 7.4990 1.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 5.6870 2.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 6.4710 2.7090 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2280 7.4450 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7970 6.6380 4.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9890 5.9770 4.9350 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7340 6.7270 5.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5340 5.0430 3.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4890 5.7310 2.7050 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3100 6.4440 2.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5450 4.7280 1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8460 4.1390 1.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5270 5.2720 6.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 3.9450 6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8430 3.6580 7.4330 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8870 4.7790 8.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 5.8240 7.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 7.0570 7.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1720 7.3080 9.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 6.3330 9.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5480 6.5520 10.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5970 5.0620 9.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 4.1840 10.3020 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 8.5880 9.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 5.6670 -2.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 -0.7300 -0.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 1.9050 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 4.3990 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 2.8070 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 6.2240 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7190 5.5080 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 6.1220 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7280 7.6940 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3380 5.2410 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 3.9480 1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9540 3.4910 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2780 3.2390 5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6220 9.2920 9.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1180 8.7890 10.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5180 5.8280 -2.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7820 -1.6020 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9000 0.0740 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 6.4160 -0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 5.6110 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 11 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 10 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 47 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 22 65 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 35 36 1 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 59 1 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 44 1 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 41 46 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 44 45 2 0 0 0 0 46 60 1 0 0 0 0 46 61 1 0 0 0 0 47 62 1 0 0 0 0 48 63 1 0 0 0 0 48 64 1 0 0 0 0 65 66 1 0 0 0 0 M END