SIAL-ZINC04534069 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 0.0110 1.5370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.0070 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0040 -0.3630 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7440 -0.4980 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -0.8640 1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -0.5430 2.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -1.0340 3.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8590 -0.7380 3.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -2.5600 3.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -0.4450 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 0.3110 4.7320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -0.7580 6.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.1850 7.2530 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2820 0.8310 7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -1.0400 7.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 -0.9680 6.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -1.8820 5.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -1.8160 4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1640 -0.8350 4.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 0.0780 5.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 0.0090 6.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -0.1580 8.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -0.5760 8.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 0.3310 9.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 0.2680 10.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 0.4170 10.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 0.3540 11.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4250 0.1420 12.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -0.0060 12.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.0610 11.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 0.0750 13.8680 N 0 3 0 0 0 0 0 0 0 0 0 0 5.5780 0.2050 13.6580 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -0.1110 15.0020 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0360 1.9070 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 1.9020 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.8910 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -0.2500 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 -2.9860 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -2.9250 4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -2.8560 3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.3620 6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -2.0750 7.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -0.6660 8.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -2.6480 5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1940 -2.5290 3.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 -0.7830 3.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 0.8440 5.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 0.7210 7.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 0.7270 9.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 0.5810 9.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 0.4690 11.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -0.1720 13.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.0500 12.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -0.1410 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.4710 -1.2070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -1.4770 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 55 1 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 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 22 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 46 1 0 0 0 0 20 21 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 31 1 M CHG 1 33 -1 M END