IFLAB-ZINC04305194 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 1 0 0 0 0 0999 V2000 6.8130 2.1180 1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 2.6370 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1560 1.9690 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 0.7650 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3130 0.2540 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3650 0.9250 1.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -1.0390 1.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -0.9640 0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6720 -0.0800 -0.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 -0.8650 -1.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9810 -0.2650 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -2.1230 -1.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -1.7460 -1.7550 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -2.7830 -2.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.1510 -2.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -3.2020 -3.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -4.2140 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1510 -4.2720 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -5.3950 0.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -6.4600 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -6.4030 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 -5.2820 -1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -7.6620 1.1470 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0460 -7.7120 2.1220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4110 -8.6010 0.8820 O 0 5 0 0 0 0 0 0 0 0 0 0 5.5410 -1.2610 -1.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -1.2740 -2.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6760 -1.7080 -1.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4190 -1.9330 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1260 -1.6560 -0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6390 2.6410 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 3.5700 -0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6850 2.3800 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8380 0.5190 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2090 -1.9000 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 -1.0730 2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -1.9520 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -0.5210 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -2.6370 -2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -2.7850 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -0.8890 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -3.4400 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 -5.4400 1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -7.2350 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -5.2380 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -1.0060 -3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6250 -1.8340 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1330 -2.2760 0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 29 2 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END