IFLAB-ZINC04939493 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 57 0 0 1 0 0 0 0 0999 V2000 -0.8880 -0.6490 -0.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 0.3540 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -0.2560 1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1200 -0.8850 0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 -1.4660 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -1.4330 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -0.8170 3.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -0.2330 2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -1.9810 4.3460 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3650 -2.6130 4.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0460 -2.8460 3.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8350 -2.9990 5.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3130 -3.3610 5.7460 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5990 -4.1010 4.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -3.8910 7.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6530 -3.1580 7.6030 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 -2.1140 4.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8190 -0.7910 4.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6640 -0.7430 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8250 0.8020 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 2.1840 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5330 2.3560 2.1430 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0660 2.2600 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4490 0.8860 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 -1.0260 0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4680 -0.1790 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 -1.5090 -0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7490 0.7420 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 1.2200 0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -0.9310 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 -1.9440 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8030 -0.7780 4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 0.2370 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -1.8970 5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -2.1780 6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 -3.8540 6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4280 -2.2540 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7430 -2.9640 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1070 0.0440 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4500 -0.6800 5.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4610 -1.4950 2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0260 -0.9030 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 0.6890 0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5560 0.0050 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8770 2.2920 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7230 2.9810 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9240 2.4200 4.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3460 3.0650 3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1840 0.0860 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0370 0.8490 4.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -4.8690 7.6230 O 0 5 0 0 0 0 0 0 0 0 0 0 7.1830 -2.1020 5.5220 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6420 -1.2390 5.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7600 -2.1860 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3120 0.6190 2.7900 N 0 3 0 0 0 0 0 0 0 0 0 0 9.5850 1.3320 2.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 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 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 52 1 0 0 0 0 15 16 2 0 0 0 0 15 51 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 55 1 0 0 0 0 52 53 1 0 0 0 0 52 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 1 M CHG 1 55 1 M END