SIAL-ZINC02166234 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2440 -0.0640 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -0.0730 -1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 -2.0000 -1.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.6060 -2.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0650 -3.9840 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -4.7590 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 -4.1490 -0.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -2.7710 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 -4.9740 0.7100 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2090 -4.4370 1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -6.1880 0.6550 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7260 -4.6310 -3.6290 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1990 -3.9500 -4.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -5.8460 -3.6880 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -0.5060 -0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6980 -0.4250 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2500 1.0140 -1.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -2.0020 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -2.2960 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -6.1140 -1.5210 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.5310 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 15 1 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 28 29 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M CHG 1 15 1 M CHG 1 17 -1 M END