SIAL-ZINC00000058 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4650 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8180 -0.5230 1.1320 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8880 -0.4600 0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -1.9830 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -1.9990 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -0.5480 0.2770 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0020 -0.5050 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9240 0.2330 1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -0.0460 2.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 0.2710 2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 0.7920 3.8050 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 0.3050 5.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -0.7850 5.2070 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 1.1190 6.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8450 1.3170 6.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 2.4440 6.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 3.2210 5.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4840 0.3530 7.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 0.0170 8.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 -0.6860 9.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -1.0530 9.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.7180 8.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -0.0200 7.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.5050 -1.2740 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9940 1.8430 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 1.8240 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4000 1.8180 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 -2.6610 0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3370 -2.2570 2.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1630 -2.6860 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -2.2820 1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 1.3010 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -0.0880 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -1.0950 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -0.0320 3.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 1.3370 2.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 2.9940 7.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 2.2460 6.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 4.0770 5.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5290 0.3040 8.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0530 -0.9470 10.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -1.6020 10.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -1.0050 9.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6180 0.2390 7.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 25 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 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 45 1 0 0 0 0 M CHG 1 2 1 M CHG 1 25 -1 M END