SIAL-ZINC04545850 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 54 0 0 1 0 0 0 0 0999 V2000 0.2240 -1.0190 -2.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.4470 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 1.0190 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 -0.6320 -0.2170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6720 -0.1250 0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -2.1230 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -2.7330 -0.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1810 -2.6940 0.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -4.0820 1.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8110 -4.6820 0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 -4.1730 2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -3.5420 2.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3590 -4.0210 2.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -3.4070 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8130 -2.3200 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 -1.8480 3.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -2.4570 3.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -4.6770 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 -3.8020 1.7830 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 -0.1210 -0.8120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 1.1620 -0.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 2.0360 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 1.5330 -1.4340 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.5420 1.5460 -2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9910 0.6300 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2500 1.0650 -1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4560 0.1340 -1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2720 -0.8730 -1.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 -0.9180 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -2.0840 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -0.4980 -3.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2530 -0.9920 -0.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 1.6220 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.4540 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 1.1030 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -2.1990 1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0120 -5.2240 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -3.7080 3.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -4.8580 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -3.7700 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 -1.8410 3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 -1.0020 4.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -2.0750 4.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5950 -0.8150 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7430 -0.4000 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1950 0.6020 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 2.0570 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0290 1.1340 -2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -5.9370 1.6880 O 0 5 0 0 0 0 0 0 0 0 0 0 -8.4850 0.5150 -2.3690 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.1560 2.9510 -1.0810 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7250 3.4080 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 3.4850 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 2.9890 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 20 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 51 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 51 54 1 0 0 0 0 M CHG 1 49 -1 M CHG 1 50 -1 M CHG 1 51 1 M END