IFLAB-ZINC05143187 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2180 -0.6610 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0150 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.3340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0590 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 2.0580 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2060 2.3580 -1.7350 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7430 3.1990 -1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4610 3.6050 -2.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6620 4.2620 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0820 4.4790 -1.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3330 4.0580 -0.1480 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2160 3.4530 -0.3340 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3620 5.1790 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7810 5.3950 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9720 6.0450 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7550 6.4850 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3400 6.2710 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1530 5.6160 -1.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9640 7.1460 -0.1440 N 0 0 0 0 0 0 0 0 0 0 0 0 13.8370 7.6340 -1.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8630 8.1890 -0.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6280 8.0480 0.9030 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4920 7.4300 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9230 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.7410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 3.1380 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5870 3.0110 0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4430 1.4500 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 3.4110 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2570 4.5970 -3.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1720 5.0540 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2960 6.2130 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9500 6.6150 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8330 5.4460 -2.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7240 7.5820 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7250 8.6660 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0460 7.1820 2.0280 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 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 32 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 25 40 1 0 0 0 0 M END