SIAL-ZINC04789964 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 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 2.1650 -0.0790 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 0.7340 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0110 1.1180 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8200 0.6880 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3020 -0.1250 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -0.5050 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -2.0230 -1.3290 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1040 -2.4560 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 -2.5170 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 -2.4260 -1.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -3.6210 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -4.3070 -0.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -4.0960 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -3.3130 -1.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -3.7620 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -4.9880 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1240 -5.7800 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -5.3470 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 -6.1920 0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -6.0810 1.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -7.0900 0.2870 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.6370 -7.4710 0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6160 -7.7870 0.7880 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 2.0510 1.0700 -3.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.7530 -2.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8570 0.9870 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9340 -0.4610 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -1.1370 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3930 -2.2140 -2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 -3.6040 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 -2.0840 -3.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2300 -2.3540 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 -3.1520 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1300 -5.3300 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -7.0860 -0.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -7.6170 -0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END