IFLAB-ZINC02710361 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -1.9930 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 -2.8710 0.2350 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -4.2310 -0.0180 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2420 -2.4040 1.4930 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -2.4240 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -3.1270 -2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 -2.7900 -3.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -1.7220 -2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -1.0220 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -1.3820 -0.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0590 0.2430 -1.5920 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.6280 -0.2540 -3.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9360 -1.2510 -3.6120 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 0.3400 -3.8670 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0290 -0.1220 -5.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4330 -1.0590 -5.5740 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1460 0.5140 -5.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5100 0.0320 -7.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5570 0.6370 -7.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2060 1.7040 -7.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7910 2.1300 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7970 1.5340 -5.2720 N 0 0 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -2.4450 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4330 -3.9470 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -3.3460 -3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 -0.8390 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1480 1.0880 -3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9820 -0.8010 -7.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8620 0.2860 -8.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.0260 2.1980 -7.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2940 2.9610 -5.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 M END