IFLAB-ZINC04033738 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -1.4550 0.3100 0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -0.9710 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -1.3200 1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 -2.5020 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -3.3250 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -2.9750 -0.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -1.8010 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 -1.3690 -2.3640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -0.4850 2.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -1.0070 3.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -2.7040 3.7980 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -0.1940 4.6650 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 1.2670 4.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 1.7970 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 1.1450 6.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1930 0.0160 6.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7290 -0.2610 8.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -1.0120 8.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 0.7120 8.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6560 1.5480 7.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -0.7460 6.0310 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4030 -1.8040 5.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 -0.5710 6.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6920 0.6980 6.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 0.8600 7.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -0.2500 7.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -1.5220 7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -1.6810 7.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8510 -0.0940 8.5370 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 1.1200 -0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 0.1900 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 0.5460 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 -2.7760 2.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -4.2440 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -3.6200 -1.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 0.4710 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 1.7180 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 1.5190 3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 2.8780 5.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 1.5560 4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 0.7850 9.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 1.5640 6.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.8520 7.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -2.3880 7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -2.6720 6.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 9 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 9 36 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 21 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 M END